C₁₄H₂₀O_8,8.75(O)

C₁₄H₂₀O_8,8.75(O)

Cui, PengMcMahon, David P.Spackman, Peter R.Alston, Ben M.Little, Marc A.Day, Graeme M.Cooper, Andrew I.

Chemical Science (2019) 10, 43 9988

a=11.4074(5)Å   b=11.4074(5)Å   c=11.4074(5)Å

α=90°   β=90°   γ=90°

C₁₄H₁₆O_8,0.25(C₄H₈O)

C₁₄H₁₆O_8,0.25(C₄H₈O)

Cui, PengMcMahon, David P.Spackman, Peter R.Alston, Ben M.Little, Marc A.Day, Graeme M.Cooper, Andrew I.

Chemical Science (2019) 10, 43 9988

a=16.4008(15)Å   b=16.4008(15)Å   c=22.397(2)Å

α=90°   β=90°   γ=90°

2(C₁₄H₁₆O₈)_,4(C₈H₁₀O₂)

2(C₁₄H₁₆O₈)_,4(C₈H₁₀O₂)

Cui, PengMcMahon, David P.Spackman, Peter R.Alston, Ben M.Little, Marc A.Day, Graeme M.Cooper, Andrew I.

Chemical Science (2019) 10, 43 9988

a=16.2380(2)Å   b=16.2380(2)Å   c=22.3825(3)Å

α=90°   β=90°   γ=90°

C₁₄H₁₆O_8,0.43(C₁₄H₃₀)

C₁₄H₁₆O_8,0.43(C₁₄H₃₀)

Cui, PengMcMahon, David P.Spackman, Peter R.Alston, Ben M.Little, Marc A.Day, Graeme M.Cooper, Andrew I.

Chemical Science (2019) 10, 43 9988

a=7.3713(11)Å   b=22.951(4)Å   c=23.585(4)Å

α=90°   β=90°   γ=90°

C₉H₆O_6,2.25(H₂O)

C₉H₆O_6,2.25(H₂O)

Cui, PengMcMahon, David P.Spackman, Peter R.Alston, Ben M.Little, Marc A.Day, Graeme M.Cooper, Andrew I.

Chemical Science (2019) 10, 43 9988

a=3.5960(9)Å   b=8.934(2)Å   c=17.937(4)Å

α=77.839(7)°   β=86.729(7)°   γ=88.967(7)°

C₁₄H₁₆O_8,0.43(C₁₄H₃₀)

C₁₄H₁₆O_8,0.43(C₁₄H₃₀)

Cui, PengMcMahon, David P.Spackman, Peter R.Alston, Ben M.Little, Marc A.Day, Graeme M.Cooper, Andrew I.

Chemical Science (2019) 10, 43 9988

a=16.429(3)Å   b=16.429(3)Å   c=7.3580(12)Å

α=90°   β=90°   γ=90°

C₉H₆O_6,C₆H₁₀O

C₉H₆O_6,C₆H₁₀O

Cui, PengMcMahon, David P.Spackman, Peter R.Alston, Ben M.Little, Marc A.Day, Graeme M.Cooper, Andrew I.

Chemical Science (2019) 10, 43 9988

a=27.254(3)Å   b=16.7260(16)Å   c=6.7365(6)Å

α=90°   β=100.207(3)°   γ=90°

C₉H₆O₆

C₉H₆O₆

Cui, PengMcMahon, David P.Spackman, Peter R.Alston, Ben M.Little, Marc A.Day, Graeme M.Cooper, Andrew I.

Chemical Science (2019) 10, 43 9988

a=26.075(2)Å   b=16.4837(12)Å   c=3.6749(3)Å

α=90°   β=95.076(2)°   γ=90°

C₉H₆O₆

C₉H₆O₆

Cui, PengMcMahon, David P.Spackman, Peter R.Alston, Ben M.Little, Marc A.Day, Graeme M.Cooper, Andrew I.

Chemical Science (2019) 10, 43 9988

a=26.240(5)Å   b=16.529(3)Å   c=3.7452(7)Å

α=90°   β=96.283(6)°   γ=90°

C₉H₆O_0,7.5(O)

C₉H₆O_0,7.5(O)

Cui, PengMcMahon, David P.Spackman, Peter R.Alston, Ben M.Little, Marc A.Day, Graeme M.Cooper, Andrew I.

Chemical Science (2019) 10, 43 9988

a=25.869(4)Å   b=16.419(3)Å   c=3.6060(6)Å

α=90°   β=93.617(4)°   γ=90°

C₉H₆O_6,C₃H₈O

C₉H₆O_6,C₃H₈O

Cui, PengMcMahon, David P.Spackman, Peter R.Alston, Ben M.Little, Marc A.Day, Graeme M.Cooper, Andrew I.

Chemical Science (2019) 10, 43 9988

a=9.1671(17)Å   b=9.4589(18)Å   c=9.6179(17)Å

α=93.220(5)°   β=116.280(5)°   γ=118.728(5)°

C₉H₆O_6,5.38(H₂O)

C₉H₆O_6,5.38(H₂O)

Cui, PengMcMahon, David P.Spackman, Peter R.Alston, Ben M.Little, Marc A.Day, Graeme M.Cooper, Andrew I.

Chemical Science (2019) 10, 43 9988

a=25.768(4)Å   b=16.425(2)Å   c=3.6006(5)Å

α=90°   β=93.333(4)°   γ=90°

3(C₉H₆O₆)_,2(C₁₂H₁₀O)

3(C₉H₆O₆)_,2(C₁₂H₁₀O)

Cui, PengMcMahon, David P.Spackman, Peter R.Alston, Ben M.Little, Marc A.Day, Graeme M.Cooper, Andrew I.

Chemical Science (2019) 10, 43 9988

a=10.50240(6)Å   b=15.88590(7)Å   c=16.60930(7)Å

α=113.7260(4)°   β=98.4480(4)°   γ=106.8020(4)°

C₉H₆O_6,2(H₂O)

C₉H₆O_6,2(H₂O)

Cui, PengMcMahon, David P.Spackman, Peter R.Alston, Ben M.Little, Marc A.Day, Graeme M.Cooper, Andrew I.

Chemical Science (2019) 10, 43 9988

a=16.5141(6)Å   b=16.5141(6)Å   c=9.7096(4)Å

α=90°   β=90°   γ=120°

2(C₉H₆O₆)_,8(O)

2(C₉H₆O₆)_,8(O)

Cui, PengMcMahon, David P.Spackman, Peter R.Alston, Ben M.Little, Marc A.Day, Graeme M.Cooper, Andrew I.

Chemical Science (2019) 10, 43 9988

a=16.5230(16)Å   b=16.5230(16)Å   c=19.400(2)Å

α=90°   β=90°   γ=120°

(C₁₄H₂₀O₈)_,17.5(O)

(C₁₄H₂₀O₈)_,17.5(O)

Cui, PengMcMahon, David P.Spackman, Peter R.Alston, Ben M.Little, Marc A.Day, Graeme M.Cooper, Andrew I.

Chemical Science (2019) 10, 43 9988

a=11.4331(8)Å   b=11.4331(8)Å   c=11.4312(8)Å

α=90°   β=90°   γ=90°

2(C₉H₆O₆)_,2(C₃H₈O)

2(C₉H₆O₆)_,2(C₃H₈O)

Cui, PengMcMahon, David P.Spackman, Peter R.Alston, Ben M.Little, Marc A.Day, Graeme M.Cooper, Andrew I.

Chemical Science (2019) 10, 43 9988

a=19.0126(17)Å   b=9.6004(8)Å   c=27.383(2)Å

α=90°   β=90.563(2)°   γ=90°

C₄₈H₄₈N_12,CH₂Cl_2,C₈H₁₀

C₄₈H₄₈N_12,CH₂Cl_2,C₈H₁₀

McMahon, David P.Stephenson, AndrewChong, Samantha Y.Little, MarcJones, James T. A.Cooper, Andrew I.Day, Graeme Matthew

Faraday Discussions (2018)

a=16.565(4)Å   b=10.745(3)Å   c=31.067(8)Å

α=90°   β=92.088(6)°   γ=90°

2(C₄₈H₄₈N₁₂)_,7.75(CH₂Cl₂)

2(C₄₈H₄₈N₁₂)_,7.75(CH₂Cl₂)

McMahon, David P.Stephenson, AndrewChong, Samantha Y.Little, MarcJones, James T. A.Cooper, Andrew I.Day, Graeme Matthew

Faraday Discussions (2018)

a=21.3987(16)Å   b=21.3987(16)Å   c=21.3164(18)Å

α=90°   β=90°   γ=120°

C₄₈H₄₈N_12,2(C₈H₁₀)_,C₁H₁Cl₃

C₄₈H₄₈N_12,2(C₈H₁₀)_,C₁H₁Cl₃

McMahon, David P.Stephenson, AndrewChong, Samantha Y.Little, MarcJones, James T. A.Cooper, Andrew I.Day, Graeme Matthew

Faraday Discussions (2018)

a=10.654(3)Å   b=23.151(6)Å   c=25.363(7)Å

α=90°   β=90°   γ=90°

2(C₄₈H₄₈N₁₂)_,10(C₁Cl₄)

2(C₄₈H₄₈N₁₂)_,10(C₁Cl₄)

McMahon, David P.Stephenson, AndrewChong, Samantha Y.Little, MarcJones, James T. A.Cooper, Andrew I.Day, Graeme Matthew

Faraday Discussions (2018)

a=24.3478(5)Å   b=24.3478(5)Å   c=24.3478(5)Å

α=90°   β=90°   γ=90°

2(C₄₈H₄₈N₁₂)_,11.32(CHCl₃)

2(C₄₈H₄₈N₁₂)_,11.32(CHCl₃)

McMahon, David P.Stephenson, AndrewChong, Samantha Y.Little, MarcJones, James T. A.Cooper, Andrew I.Day, Graeme Matthew

Faraday Discussions (2018)

a=17.1487(11)Å   b=18.3913(11)Å   c=24.7171(15)Å

α=73.378(2)°   β=72.980(2)°   γ=76.700(2)°

2NaG

C₁₇H₁₈N₂O₅

Adams, Dave J.Morris, KyleChen, LinSerpell, Louise C.Bacsa, JohnDay, Graeme M.

Soft Matter (2010) 6, 17 4144

a=9.872(5)Å   b=4.921(3)Å   c=16.859(9)Å

α=90.00°   β=96.518(9)°   γ=90.00°

DA201109

C₁₇H₁₈N₂O₅

Adams, Dave J.Morris, KyleChen, LinSerpell, Louise C.Bacsa, JohnDay, Graeme M.

Soft Matter (2010) 6, 17 4144

a=9.9170(10)Å   b=11.1123(11)Å   c=28.247(3)Å

α=90.00°   β=90.00°   γ=90.00°

C₆₆H₇₂N₁₂

C₆₆H₇₂N₁₂

Pyzer-Knapp, Edward O.Thompson, Hugh P. G.Schiffmann, FlorianJelfs, Kim E.Chong, Samantha Y.Little, Marc A.Cooper, Andrew I.Day, Graeme M.

Chemical Science (2014) 5, 6 2235

a=24.242(9)Å   b=24.242(9)Å   c=24.242(9)Å

α=90.00°   β=90.00°   γ=90.00°

C₈H₁₀N₄O_2,C₇H₄F₂O₂

C₈H₁₀N₄O_2,C₇H₄F₂O₂

Bučar, Dejan-KrešimirDay, Graeme M.Halasz, IvanZhang, Geoff G. Z.Sander, John R. G.Reid, David G.MacGillivray, Leonard R.Duer, Melinda J.Jones, William

Chemical Science (2013) 4, 12 4417

a=11.39598(91)Å   b=9.15968(51)Å   c=15.8701(12)Å

α=90°   β=104.0247(43)°   γ=90°

C₈H₁₀N₄O_2,C₇H₆O₂

C₈H₁₀N₄O_2,C₇H₆O₂

Bučar, Dejan-KrešimirDay, Graeme M.Halasz, IvanZhang, Geoff G. Z.Sander, John R. G.Reid, David G.MacGillivray, Leonard R.Duer, Melinda J.Jones, William

Chemical Science (2013) 4, 12 4417

a=11.2358(13)Å   b=9.1056(10)Å   c=15.9131(18)Å

α=90°   β=104.5787(42)°   γ=90°

C₈H₁₀N₄O_2,C₇H₄F₂O₂

C₈H₁₀N₄O_2,C₇H₄F₂O₂

Bučar, Dejan-KrešimirDay, Graeme M.Halasz, IvanZhang, Geoff G. Z.Sander, John R. G.Reid, David G.MacGillivray, Leonard R.Duer, Melinda J.Jones, William

Chemical Science (2013) 4, 12 4417

a=11.36104(82)Å   b=9.11522(46)Å   c=15.8828(13)Å

α=90°   β=101.7770(41)°   γ=90°

C₈H₁₀N₄O_2,C₇H₄F₂O₂

C₈H₁₀N₄O_2,C₇H₄F₂O₂

Bučar, Dejan-KrešimirDay, Graeme M.Halasz, IvanZhang, Geoff G. Z.Sander, John R. G.Reid, David G.MacGillivray, Leonard R.Duer, Melinda J.Jones, William

Chemical Science (2013) 4, 12 4417

a=11.33562(74)Å   b=9.12362(42)Å   c=15.9442(11)Å

α=90°   β=104.2599(39)°   γ=90°

C₈H₁₀N₄O_2,C₇H₂F₄O₂

C₈H₁₀N₄O_2,C₇H₂F₄O₂

Bučar, Dejan-KrešimirDay, Graeme M.Halasz, IvanZhang, Geoff G. Z.Sander, John R. G.Reid, David G.MacGillivray, Leonard R.Duer, Melinda J.Jones, William

Chemical Science (2013) 4, 12 4417

a=14.2630(11)Å   b=8.13716(48)Å   c=16.0129(16)Å

α=90°   β=121.2142(35)°   γ=90°

C₈H₁₀N₄O_2,C₇H₅F₁O₂

C₈H₁₀N₄O_2,C₇H₅F₁O₂

Bučar, Dejan-KrešimirDay, Graeme M.Halasz, IvanZhang, Geoff G. Z.Sander, John R. G.Reid, David G.MacGillivray, Leonard R.Duer, Melinda J.Jones, William

Chemical Science (2013) 4, 12 4417

a=11.30697(76)Å   b=9.06586(42)Å   c=15.94455(91)Å

α=90°   β=105.2800(33)°   γ=90°

C₈H₁₀N₄O_2,C₇H₅F₁O₂

C₈H₁₀N₄O_2,C₇H₅F₁O₂

Bučar, Dejan-KrešimirDay, Graeme M.Halasz, IvanZhang, Geoff G. Z.Sander, John R. G.Reid, David G.MacGillivray, Leonard R.Duer, Melinda J.Jones, William

Chemical Science (2013) 4, 12 4417

a=8.78113(87)Å   b=10.06607(56)Å   c=10.5609(14)Å

α=105.8710(58)°   β=72.7172(63)°   γ=71.1516(63)°

4-chlorophenyl-4'-nitrophenyl disulfide

C₁₂H₈ClNO₂S₂

Belenguer, Ana M.Friščić, TomislavDay, Graeme M.Sanders, Jeremy K. M.

Chemical Science (2011) 2, 4 696

a=13.4561(3)Å   b=7.1030(2)Å   c=13.8346(4)Å

α=90.00°   β=109.73(3)°   γ=90.00°

Bis(4-methylphenyl)disulfide

C₁₄H₁₄S₂

Belenguer, Ana M.Friščić, TomislavDay, Graeme M.Sanders, Jeremy K. M.

Chemical Science (2011) 2, 4 696

a=7.6164(2)Å   b=5.7256(2)Å   c=14.7508(5)Å

α=90.00°   β=94.881(2)°   γ=90.00°

C₈H₁₆N₄O₇

C₈H₁₆N₄O₇

Pinter, Emily N.Cantrell, Lee S.Day, Graeme M.Wheeler, Kraig A.

CrystEngComm (2018) 20, 30 4213

a=8.0233(5)Å   b=7.9864(6)Å   c=9.3673(6)Å

α=90°   β=95.686(2)°   γ=90°

C₄H₈N₂O₃

C₄H₈N₂O₃

Pinter, Emily N.Cantrell, Lee S.Day, Graeme M.Wheeler, Kraig A.

CrystEngComm (2018) 20, 30 4213

a=9.4044(2)Å   b=8.2033(2)Å   c=7.7750(2)Å

α=90°   β=101.659(1)°   γ=90°

C₆H₁₂N₂O₄

C₆H₁₂N₂O₄

Pinter, Emily N.Cantrell, Lee S.Day, Graeme M.Wheeler, Kraig A.

CrystEngComm (2018) 20, 30 4213

a=9.8954(4)Å   b=19.3100(9)Å   c=8.9868(4)Å

α=90°   β=90°   γ=90°

C₁₂H₂₄N₂O_3,C₁₂H₂₄N₂O₄

C₁₂H₂₄N₂O_3,C₁₂H₂₄N₂O₄

Pinter, Emily N.Cantrell, Lee S.Day, Graeme M.Wheeler, Kraig A.

CrystEngComm (2018) 20, 30 4213

a=4.9064(3)Å   b=8.7118(6)Å   c=17.1527(14)Å

α=102.543(7)°   β=96.249(5)°   γ=90.472(5)°

C₆H₁₂N₂O₃

C₆H₁₂N₂O₃

Pinter, Emily N.Cantrell, Lee S.Day, Graeme M.Wheeler, Kraig A.

CrystEngComm (2018) 20, 30 4213

a=19.637(4)Å   b=4.9347(13)Å   c=8.4645(17)Å

α=90°   β=92.281(12)°   γ=90°

C₆H₁₂N₂O_4,C₆H₁₂N₂O₃

C₆H₁₂N₂O_4,C₆H₁₂N₂O₃

Pinter, Emily N.Cantrell, Lee S.Day, Graeme M.Wheeler, Kraig A.

CrystEngComm (2018) 20, 30 4213

a=5.0193(3)Å   b=8.6051(6)Å   c=10.2069(7)Å

α=69.005(4)°   β=77.721(4)°   γ=89.513(4)°

C₄H₆N₂O₄

C₄H₆N₂O₄

Lewis, T. C.Tocher, D. A.Day, G. M.Price, S. L.

CrystEngComm (2003) 5, 2 3

a=5.5028(13)Å   b=7.0583(16)Å   c=8.2718(19)Å

α=70.112(4)°   β=85.814(4)°   γ=74.095(4)°

C₁₅H₁₂N₂O_,C₂H₆OS

C₁₅H₁₂N₂O_,C₂H₆OS

Cruz-Cabeza, Aurora JDay, Graeme M.Jones, William

Physical chemistry chemical physics : PCCP (2011) 13, 28 12808-12816

a=7.4105(3)Å   b=8.9753(3)Å   c=12.2407(4)Å

α=94.259(2)°   β=94.526(3)°   γ=100.200(2)°

C₁₅H₁₂N₂O_,C₂H₆OS

C₁₅H₁₂N₂O_,C₂H₆OS

Cruz-Cabeza, Aurora JDay, Graeme M.Jones, William

Physical chemistry chemical physics : PCCP (2011) 13, 28 12808-12816

a=7.3605(2)Å   b=8.9292(3)Å   c=12.2136(3)Å

α=94.491(2)°   β=94.715(2)°   γ=100.070(2)°

C₁₅H₁₂N₂O_,C₂H₆OS

C₁₅H₁₂N₂O_,C₂H₆OS

Cruz-Cabeza, Aurora JDay, Graeme M.Jones, William

Physical chemistry chemical physics : PCCP (2011) 13, 28 12808-12816

a=7.3605(2)Å   b=8.9292(3)Å   c=12.2136(3)Å

α=94.491(2)°   β=94.715(2)°   γ=100.070(2)°

C₁₅H₁₂N₂O_,C₂H₆OS

C₁₅H₁₂N₂O_,C₂H₆OS

Cruz-Cabeza, Aurora JDay, Graeme M.Jones, William

Physical chemistry chemical physics : PCCP (2011) 13, 28 12808-12816

a=8.8708(2)Å   b=12.1901(3)Å   c=14.6128(4)Å

α=94.9700(10)°   β=100.2170(10)°   γ=95.0360(10)°

C₁₅H₁₂N₂O_2,C₂H₆OS

C₁₅H₁₂N₂O_2,C₂H₆OS

Cruz-Cabeza, Aurora JDay, Graeme M.Jones, William

Physical chemistry chemical physics : PCCP (2011) 13, 28 12808-12816

a=10.6987(2)Å   b=12.4986(3)Å   c=11.9748(3)Å

α=90.00°   β=91.0670(10)°   γ=90.00°

Coumarin-3-carboxylic acid+4,4'-bipyridylethene

C₁₂H₁₀N_2,2(C₁₀H₆O₄)

Yan, DongpengDelori, AmitLloyd, Gareth O.Patel, BhavnitaFriščić, TomislavDay, Graeme M.Bučar, Dejan-KrešimirJones, WilliamLu, JunWei, MinEvans, David G.Duan, Xue

CrystEngComm (2012) 14, 16 5121

a=16.2227(4)Å   b=5.02570(10)Å   c=16.3150(5)Å

α=90.00°   β=100.9180(10)°   γ=90.00°

Coumarin-3-carboxylic acid+4,4'-bipyridine

2(C₁₀H₆O₄)_,C₁₀H₈N₂

Yan, DongpengDelori, AmitLloyd, Gareth O.Patel, BhavnitaFriščić, TomislavDay, Graeme M.Bučar, Dejan-KrešimirJones, WilliamLu, JunWei, MinEvans, David G.Duan, Xue

CrystEngComm (2012) 14, 16 5121

a=3.90990(10)Å   b=20.2636(3)Å   c=15.3093(3)Å

α=90.00°   β=91.3460(10)°   γ=90.00°

Coumarin-3-carboxylic acid+4,4'-bipyridylethane

C₁₂H₁₂N_2,2(C₁₀H₆O₄)

Yan, DongpengDelori, AmitLloyd, Gareth O.Patel, BhavnitaFriščić, TomislavDay, Graeme M.Bučar, Dejan-KrešimirJones, WilliamLu, JunWei, MinEvans, David G.Duan, Xue

CrystEngComm (2012) 14, 16 5121

a=16.3933(6)Å   b=4.8921(2)Å   c=16.5326(8)Å

α=90.00°   β=103.209(2)°   γ=90.00°

Coumarin-3-carboxylic acid+pyridine-2,6-diamine

C₁₀H₅O_4,C₅H₈N₃

Yan, DongpengDelori, AmitLloyd, Gareth O.Patel, BhavnitaFriščić, TomislavDay, Graeme M.Bučar, Dejan-KrešimirJones, WilliamLu, JunWei, MinEvans, David G.Duan, Xue

CrystEngComm (2012) 14, 16 5121

a=13.8797(2)Å   b=12.9776(5)Å   c=7.3847(6)Å

α=90.00°   β=90.383(2)°   γ=90.00°

C₁₆H₁₃N₅O

C₁₆H₁₃N₅O

Hoxha, KreshnikCase, David H.Day, Graeme M.Prior, Timothy J.

CrystEngComm (2015) 17, 37 7130

a=20.798(2)Å   b=9.5020(5)Å   c=14.4536(16)Å

α=90°   β=100.800(9)°   γ=90°

C₁₆H₁₃N₅O

C₁₆H₁₃N₅O

Hoxha, KreshnikCase, David H.Day, Graeme M.Prior, Timothy J.

CrystEngComm (2015) 17, 37 7130

a=20.803(2)Å   b=9.5030(5)Å   c=14.7247(13)Å

α=90°   β=100.224(8)°   γ=90°

C₁₂H₂₄N₂O₄

C₁₂H₂₄N₂O₄

Pinter, Emily N.Cantrell, Lee S.Day, Graeme M.Wheeler, Kraig A.

CrystEngComm (2018) 20, 30 4213

a=31.8791(12)Å   b=5.0676(2)Å   c=8.8564(4)Å

α=90°   β=96.049(4)°   γ=90°

C₄H₈N₂O₄

C₄H₈N₂O₄

Pinter, Emily N.Cantrell, Lee S.Day, Graeme M.Wheeler, Kraig A.

CrystEngComm (2018) 20, 30 4213

a=8.0175(4)Å   b=8.1062(4)Å   c=9.2562(4)Å

α=90°   β=95.619(2)°   γ=90°

Cyt:phen

C₁₂H₈N_2,C₄H₅N₃O

Hoxha, KreshnikCase, David H.Day, Graeme M.Prior, Timothy J.

CrystEngComm (2015) 17, 37 7130

a=20.765(2)Å   b=9.4741(5)Å   c=14.1307(13)Å

α=90°   β=101.612(8)°   γ=90°

7105349

Cruz-Cabeza, Aurora JKarki, ShyamFábián, LászlóFriscić, TomislavDay, Graeme MJones, William

Chemical communications (Cambridge, England) (2010) 46, 13 2224-2226

a=5.0907Å   b=12.9686Å   c=9.2368Å

α=94.0829°   β=112.577°   γ=104.714°

Theobromine acetic acid

C₇H₈N₄O_2,C₂H₄O₂

Cruz-Cabeza, Aurora JKarki, ShyamFábián, LászlóFriscić, TomislavDay, Graeme MJones, William

Chemical communications (Cambridge, England) (2010) 46, 13 2224-2226

a=5.2185(4)Å   b=8.2901(8)Å   c=12.9358(11)Å

α=95.827(6)°   β=96.854(6)°   γ=100.333(8)°

L-allo-isoleucine:D-leucine

C₆H₁₃NO_2,C₆H₁₃NO₂

Görbitz, Carl HenrikDalhus, BjørnDay, Graeme M.

Physical chemistry chemical physics : PCCP (2010) 12, 30 8466-8477

a=5.23570(10)Å   b=5.42510(10)Å   c=13.5733(2)Å

α=87.4160(10)°   β=88.9940(10)°   γ=69.4310(10)°

L-norvaline:D-methionine

C₅H₁₁NO_2,C₅H₁₁NO₂S

Görbitz, Carl HenrikDalhus, BjørnDay, Graeme M.

Physical chemistry chemical physics : PCCP (2010) 12, 30 8466-8477

a=9.89650(10)Å   b=4.69630(10)Å   c=16.11880(10)Å

α=90.00°   β=106.9890(10)°   γ=90.00°

L-aminobutyric acid:D-norleucine

C₄H₉NO_2,C₆H₁₃NO₂

Görbitz, Carl HenrikDalhus, BjørnDay, Graeme M.

Physical chemistry chemical physics : PCCP (2010) 12, 30 8466-8477

a=5.1725(3)Å   b=5.3955(3)Å   c=12.3952(7)Å

α=92.631(2)°   β=94.747(2)°   γ=113.103(2)°

C₂₂H₈I₂O₂

C₂₂H₈I₂O₂

Day, G. M.Motherwell, W. D. S.Ammon, H. L.Boerrigter, S. X. M.Della Valle, R. G.Venuti, E.Dzyabchenko, A.Dunitz, J. D.Schweizer, B.van Eijck, B. P.Erk, P.Facelli, J. C.Bazterra, V. E.Ferraro, M. B.Hofmann, D. W. M.Leusen, F. J. J.Liang, C.Pantelides, C. C.Karamertzanis, P. G.Price, S. L.Lewis, T. C.Nowell, H.Torrisi, A.Scheraga, H. A.Arnautova, Y. A.Schmidt, M. U.Verwer, P.

Acta Crystallographica Section B (2005) 61, 5 511-527

a=4.2020(10)Å   b=20.956(4)Å   c=9.276(2)Å

α=90.00°   β=100.63(3)°   γ=90.00°

C₉H₉N₃O₅

C₉H₉N₃O₅

Day, G. M.Motherwell, W. D. S.Ammon, H. L.Boerrigter, S. X. M.Della Valle, R. G.Venuti, E.Dzyabchenko, A.Dunitz, J. D.Schweizer, B.van Eijck, B. P.Erk, P.Facelli, J. C.Bazterra, V. E.Ferraro, M. B.Hofmann, D. W. M.Leusen, F. J. J.Liang, C.Pantelides, C. C.Karamertzanis, P. G.Price, S. L.Lewis, T. C.Nowell, H.Torrisi, A.Scheraga, H. A.Arnautova, Y. A.Schmidt, M. U.Verwer, P.

Acta Crystallographica Section B (2005) 61, 5 511-527

a=12.5693(4)Å   b=4.85310(10)Å   c=17.2663(5)Å

α=90°   β=99.1624(15)°   γ=90°

Azetidine

C₃H₇N₁

Day, G. M.Motherwell, W. D. S.Ammon, H. L.Boerrigter, S. X. M.Della Valle, R. G.Venuti, E.Dzyabchenko, A.Dunitz, J. D.Schweizer, B.van Eijck, B. P.Erk, P.Facelli, J. C.Bazterra, V. E.Ferraro, M. B.Hofmann, D. W. M.Leusen, F. J. J.Liang, C.Pantelides, C. C.Karamertzanis, P. G.Price, S. L.Lewis, T. C.Nowell, H.Torrisi, A.Scheraga, H. A.Arnautova, Y. A.Schmidt, M. U.Verwer, P.

Acta Crystallographica Section B (2005) 61, 5 511-527

a=9.507(3)Å   b=9.122(3)Å   c=9.790(3)Å

α=90°   β=117.469(4)°   γ=90°

C₂₂H₂₄N₂O₇S_,0.5(C₆H₆N₂O)

C₂₂H₂₄N₂O₇S_,0.5(C₆H₆N₂O)

Dudek, Marta K.Wielgus, EwelinaPaluch, PiotrŚniechowska, JustynaKostrzewa, MaciejDay, Graeme M.Bujacz, Grzegorz D.Potrzebowski, Marek J.

Acta Crystallographica Section B (2019) 75, 5

a=12.81222(8)Å   b=12.81222(8)Å   c=29.7274(3)Å

α=90°   β=90°   γ=90°

C₂₂H₂₄N₂O₇S_,0.5(C₆H₆O₂)_,0.5(H₂O)

C₂₂H₂₄N₂O₇S_,0.5(C₆H₆O₂)_,0.5(H₂O)

Dudek, Marta K.Wielgus, EwelinaPaluch, PiotrŚniechowska, JustynaKostrzewa, MaciejDay, Graeme M.Bujacz, Grzegorz D.Potrzebowski, Marek J.

Acta Crystallographica Section B (2019) 75, 5

a=12.89179(7)Å   b=12.89179(7)Å   c=29.5087(3)Å

α=90°   β=90°   γ=90°

C₂₂H₂₄N₂O₇S

C₂₂H₂₄N₂O₇S

Dudek, Marta K.Wielgus, EwelinaPaluch, PiotrŚniechowska, JustynaKostrzewa, MaciejDay, Graeme M.Bujacz, Grzegorz D.Potrzebowski, Marek J.

Acta Crystallographica Section B (2019) 75, 5

a=8.71353(13)Å   b=29.4960(6)Å   c=17.6717(2)Å

α=90°   β=97.9370(14)°   γ=90°

C₂₂H₂₄N₂O₇S_,0.5(C₃H₆N₂O)

C₂₂H₂₄N₂O₇S_,0.5(C₃H₆N₂O)

Dudek, Marta K.Wielgus, EwelinaPaluch, PiotrŚniechowska, JustynaKostrzewa, MaciejDay, Graeme M.Bujacz, Grzegorz D.Potrzebowski, Marek J.

Acta Crystallographica Section B (2019) 75, 5

a=12.85808(14)Å   b=12.85808(14)Å   c=29.5715(4)Å

α=90°   β=90°   γ=90°

C₂₂H₂₄N₂O₇S_,0.5(C₆H₈O₃)

C₂₂H₂₄N₂O₇S_,0.5(C₆H₈O₃)

Dudek, Marta K.Wielgus, EwelinaPaluch, PiotrŚniechowska, JustynaKostrzewa, MaciejDay, Graeme M.Bujacz, Grzegorz D.Potrzebowski, Marek J.

Acta Crystallographica Section B (2019) 75, 5

a=12.88747(7)Å   b=12.88747(7)Å   c=29.5246(3)Å

α=90°   β=90°   γ=90°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=7.82300Å   b=27.63680Å   c=9.81060Å

α=90°   β=112.5420°   γ=90°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=4.63220Å   b=24.67230Å   c=17.21010Å

α=90°   β=93.0760°   γ=90°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=4.56940Å   b=15.65760Å   c=27.82230Å

α=90°   β=90.4230°   γ=90°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=4.65230Å   b=12.32380Å   c=17.69700Å

α=78.4220°   β=88.0490°   γ=88.8470°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=7.82000Å   b=9.72850Å   c=14.28520Å

α=78.4470°   β=80.4540°   γ=67.4560°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=6.86720Å   b=9.26110Å   c=16.14650Å

α=85.9000°   β=80.3660°   γ=77.8150°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=8.04390Å   b=12.08700Å   c=12.15390Å

α=61.2560°   β=88.4070°   γ=75.9430°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=7.89360Å   b=34.84550Å   c=7.57860Å

α=90°   β=106.0490°   γ=90°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=4.62400Å   b=29.71420Å   c=14.49510Å

α=90°   β=92.5910°   γ=90°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=7.25000Å   b=10.20820Å   c=14.66770Å

α=83.6220°   β=76.1990°   γ=73.8000°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=17.61590Å   b=4.63220Å   c=25.06180Å

α=90°   β=97.8320°   γ=90°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=7.20920Å   b=8.21010Å   c=18.66430Å

α=87.4140°   β=84.7600°   γ=65.0430°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=12.25430Å   b=4.79740Å   c=33.90040Å

α=90°   β=95.5990°   γ=90°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=4.78250Å   b=12.25460Å   c=33.64340Å

α=90°   β=90°   γ=90°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=8.64470Å   b=10.70670Å   c=11.71540Å

α=87.4790°   β=83.4930°   γ=68.3760°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=7.48330Å   b=10.48670Å   c=13.67510Å

α=78.0920°   β=83.3590°   γ=70.7920°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=12.90230Å   b=10.90870Å   c=16.54040Å

α=90°   β=121.4760°   γ=90°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=7.60330Å   b=7.80960Å   c=18.60430Å

α=81.8980°   β=84.2360°   γ=68.3000°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=8.63300Å   b=10.72270Å   c=10.98920Å

α=91.8750°   β=99.6550°   γ=90.7700°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=19.68880Å   b=4.64040Å   c=25.15110Å

α=90°   β=119.7400°   γ=90°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=6.94410Å   b=8.73160Å   c=17.98040Å

α=89.4770°   β=82.9770°   γ=68.1410°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=19.59490Å   b=9.78610Å   c=10.60880Å

α=90°   β=92.5880°   γ=90°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=6.98490Å   b=9.14300Å   c=16.00910Å

α=86.3950°   β=83.1640°   γ=78.7810°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=14.64800Å   b=9.37790Å   c=17.03990Å

α=90°   β=120.2790°   γ=90°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=7.71050Å   b=27.84830Å   c=9.94800Å

α=90°   β=112.9390°   γ=90°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=8.19250Å   b=10.91190Å   c=12.90490Å

α=109.8010°   β=105.3870°   γ=96.7810°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=4.69770Å   b=15.72660Å   c=26.78730Å

α=90°   β=91.4260°   γ=90°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=7.88240Å   b=8.02730Å   c=17.86560Å

α=82.9840°   β=81.3480°   γ=65.2580°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=7.68880Å   b=9.86800Å   c=14.52810Å

α=94.1160°   β=101.8840°   γ=112.6300°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=4.78140Å   b=12.35100Å   c=17.43630Å

α=77.8780°   β=84.5060°   γ=88.8330°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=7.01700Å   b=38.69760Å   c=8.32240Å

α=90°   β=115.7540°   γ=90°

C₂₁H₁₇Cl₂NO₂

C₂₁H₁₇Cl₂NO₂

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=7.80900Å   b=12.25110Å   c=21.57920Å

α=90°   β=98.9600°   γ=90°