Structures by: Kahr B.

Total: 66

ROY R05

C12H9N3O2S

Tan, MelissaShtukenberg, Alexander G.Zhu, ShengcaiXu, WenqianDooryhee, EricNichols, Shane M.Ward, Michael D.Kahr, BartZhu, Qiang

Faraday discussions (2018) 211, 0 477-491

a=10.77117(50)Å   b=11.01902(13)Å   c=11.43023(26)Å

α=90.00000°   β=117.74237(23)°   γ=90.00000°

KA_D_P

C8H4DKO4

Riley, Erin A.Hess, Chelsea M.Pioquinto, Jan Rey L.Kaminsky, WernerKahr, BartReid, Philip J.

The journal of physical chemistry. B (2013) 117, 16 4313-4324

a=9.598(2)Å   b=13.320(3)Å   c=6.4599(15)Å

α=90°   β=90°   γ=90°

Kap20

C8H5KO4

Riley, Erin A.Hess, Chelsea M.Pioquinto, Jan Rey L.Kaminsky, WernerKahr, BartReid, Philip J.

The journal of physical chemistry. B (2013) 117, 16 4313-4324

a=9.5955(2)Å   b=13.2964(3)Å   c=6.46630(10)Å

α=90°   β=90°   γ=90°

Kap87

C8H5KO4

Riley, Erin A.Hess, Chelsea M.Pioquinto, Jan Rey L.Kaminsky, WernerKahr, BartReid, Philip J.

The journal of physical chemistry. B (2013) 117, 16 4313-4324

a=9.6172(6)Å   b=13.3264(10)Å   c=6.4876(4)Å

α=90°   β=90°   γ=90°

Ph4Sn

C24H20Sn

Claborn, KaceyKahr, BartKaminsky, Werner

CrystEngComm (2002) 4, 46 252

a=12.0680(4)Å   b=12.0680(4)Å   c=6.5570(3)Å

α=90.00°   β=90.00°   γ=90.00°

Ph4Ge

C24H20Ge

Claborn, KaceyKahr, BartKaminsky, Werner

CrystEngComm (2002) 4, 46 252

a=11.6160(5)Å   b=11.616Å   c=6.9020(3)Å

α=90.00°   β=90.00°   γ=90.00°

Ph4Pb

C6H5Pb0.25

Claborn, KaceyKahr, BartKaminsky, Werner

CrystEngComm (2002) 4, 46 252

a=12.1110(9)Å   b=12.1110(9)Å   c=6.5430(4)Å

α=90.00°   β=90.00°   γ=90.00°

Ph4Si

C6H5Si0.25

Claborn, KaceyKahr, BartKaminsky, Werner

CrystEngComm (2002) 4, 46 252

a=11.4476(9)Å   b=11.4476(9)Å   c=7.0644(6)Å

α=90.00°   β=90.00°   γ=90.00°

Ph4C

C6.25H5

Claborn, KaceyKahr, BartKaminsky, Werner

CrystEngComm (2002) 4, 46 252

a=10.9050(10)Å   b=10.9050(10)Å   c=7.2850(5)Å

α=90.00°   β=90.00°   γ=90.00°

L-malic acid

C4H6O5

Yang, JingxiangHu, Chunhua T.Shtukenberg, Alexander G.Yin, QiuxiangKahr, Bart

CrystEngComm (2018) 20, 10 1383

a=5.7343(6)Å   b=6.7990(7)Å   c=6.9949(7)Å

α=90°   β=104.9610(10)°   γ=90°

Crystal violet chloride

C25H30N3^^Cl^^*9H2O

Lovell, ScottMarquardt, Brian J.Kahr, Bart

Journal of the Chemical Society, Perkin Transactions 2 (1999) 11 2241

a=15.7087(4)Å   b=15.7087(4)Å   c=7.4783(2)Å

α=90°   β=90°   γ=120°

Crystal violet chloride

C25H30N3^^Cl^^*H2O

Lovell, ScottMarquardt, Brian J.Kahr, Bart

Journal of the Chemical Society, Perkin Transactions 2 (1999) 11 2241

a=10.1887(5)Å   b=21.4842(11)Å   c=21.2594(6)Å

α=90°   β=94.374(3)°   γ=90°

KA_D_P

C8H4DKO4

Riley, Erin A.Hess, Chelsea M.Pioquinto, Jan Rey L.Kaminsky, WernerKahr, BartReid, Philip J.

The journal of physical chemistry. B (2013) 117, 16 4313-4324

a=9.6164(9)Å   b=13.3282(13)Å   c=6.4869(6)Å

α=90°   β=90°   γ=90°

C2H10N2O4Se

C2H10N2O4Se

Martin, Alexander T.Nichols, Shane M.Li, SichaoTan, MelissaKahr, Bart

Journal of Applied Crystallography (2017) 50, 4 1117-1124

a=6.1352(4)Å   b=6.1352(4)Å   c=18.1726(12)Å

α=90°   β=90°   γ=90°

C11H16N1O21,Cl11

C11H16N1O21,Cl11

Morimoto, Bruce H.Lovell, ScottKahr, Bart

Acta Crystallographica Section C (1998) 54, 2 229-231

a=9.3482(2)Å   b=7.0493(3)Å   c=18.0924(7)Å

α=90°   β=90°   γ=90°

KAPdimerneedle

K,C16H11O8,2H2O1

Jason B. BenedictTheresa BullardWerner KaminskyBart Kahr

Acta Crystallographica Section C (2004) 60, 11 m551-m553

a=13.5830(3)Å   b=21.1270(5)Å   c=6.8170(2)Å

α=90.00°   β=116.5521(11)°   γ=90.00°

C18H26N8O9S2

C18H26N8O9S2

Xiao, WenchangHu, ChunhuaCarter, Damien J.Nichols, ShaneWard, Michael D.Raiteri, PaoloRohl, Andrew L.Kahr, Bart

Crystal Growth & Design (2014) 14, 8 4166

a=6.8426(5)Å   b=20.0479(14)Å   c=21.4663(15)Å

α=90.00°   β=90.00°   γ=90.00°

C22H29ClN4O3

C22H29ClN4O3

Drori, RanLi, ChaoHu, ChunhuaRaiteri, PaoloRohl, Andrew L.Ward, Michael D.Kahr, Bart

Journal of the American Chemical Society (2016) 138, 40 13396-13401

a=7.3216(3)Å   b=11.8592(4)Å   c=14.0954(5)Å

α=67.1137(6)°   β=85.7285(6)°   γ=88.6015(6)°

C24H31N5O5

C24H31N5O5

Drori, RanLi, ChaoHu, ChunhuaRaiteri, PaoloRohl, Andrew L.Ward, Michael D.Kahr, Bart

Journal of the American Chemical Society (2016) 138, 40 13396-13401

a=10.287(4)Å   b=11.630(5)Å   c=12.711(5)Å

α=63.097(4)°   β=69.525(4)°   γ=64.500(4)°

C20H23ClN4O2

C20H23ClN4O2

Drori, RanLi, ChaoHu, ChunhuaRaiteri, PaoloRohl, Andrew L.Ward, Michael D.Kahr, Bart

Journal of the American Chemical Society (2016) 138, 40 13396-13401

a=12.783(2)Å   b=7.1190(14)Å   c=22.379(4)Å

α=90°   β=97.446(3)°   γ=90°

C18H17.14ClN4O1.07

C18H17.14ClN4O1.07

Drori, RanLi, ChaoHu, ChunhuaRaiteri, PaoloRohl, Andrew L.Ward, Michael D.Kahr, Bart

Journal of the American Chemical Society (2016) 138, 40 13396-13401

a=18.8662(9)Å   b=21.1549(11)Å   c=18.2240(9)Å

α=90°   β=114.1341(10)°   γ=90°

Eric01

C19H17N3O

Antonio BarbonEric D. BottMarina BrustolonMarianna FabrisBart KahrWerner KaminskyPhilip J. ReidSusanna M. WongKristin L. WustholzRoberto Zanré

Journal of the American Chemical Society (2009) 131, 11548-11557

a=29.3750(19)Å   b=15.1467(13)Å   c=7.5187(7)Å

α=90.00°   β=91.578(7)°   γ=90.00°

Methyl red

C15H15N3O2

Jason B. BenedictDawn E. CohenScott LovellAndrew L. RohlBart Kahr

Journal of the American Chemical Society (2006)

a=8.2370(5)Å   b=8.4990(6)Å   c=11.2110(10)Å

α=92.478(3)°   β=110.281(3)°   γ=113.705(3)°

MR-25DHB

C15H15N3O2,C7H6O4

Jason B. BenedictDawn E. CohenScott LovellAndrew L. RohlBart Kahr

Journal of the American Chemical Society (2006)

a=7.0220(3)Å   b=13.5530(7)Å   c=21.8400(12)Å

α=90.00°   β=99.984(2)°   γ=90.00°

0.5PA-MR

C15H15N3O2,0.5(C8H6O4)

Jason B. BenedictDawn E. CohenScott LovellAndrew L. RohlBart Kahr

Journal of the American Chemical Society (2006)

a=9.0830(5)Å   b=14.1850(7)Å   c=26.653(2)Å

α=90.000(0)°   β=98.042(4)°   γ=90.000(0)°

C7H8O5

C7H8O5

Scott LovellParamjeet SubramonyBart Kahr

Journal of the American Chemical Society (1999) 121, 7020-7025

a=3.9424(2)Å   b=7.2936(4)Å   c=24.6902(11)Å

α=90.00°   β=94.038(3)°   γ=90.00°

C11H11BrO6

C11H11BrO6

Scott LovellParamjeet SubramonyBart Kahr

Journal of the American Chemical Society (1999) 121, 7020-7025

a=10.2025(2)Å   b=6.7648(2)Å   c=18.0353(6)Å

α=90°   β=102.846(2)°   γ=90°

C7H3O7^^K^^H2O

C7H3O7^^K^^H2O

Scott LovellParamjeet SubramonyBart Kahr

Journal of the American Chemical Society (1999) 121, 7020-7025

a=6.554(2)Å   b=16.730(4)Å   c=9.633(2)Å

α=90.00°   β=106.00(2)°   γ=90.00°

C7H3O7^^K^^*H2O

C7H3O7^^K^^*H2O

Scott LovellParamjeet SubramonyBart Kahr

Journal of the American Chemical Society (1999) 121, 7020-7025

a=10.3391(2)Å   b=12.8377(6)Å   c=14.0874(6)Å

α=90.00°   β=101.049(2)°   γ=90.00°

C28H33KN4O19S

C28H33KN4O19S

Liana WongChunhua HuRuthanne ParadiseZina ZhuAlexander ShtukenbergBart Kahr

Journal of the American Chemical Society (2012) 134, 12245-12251

a=8.3294(4)Å   b=14.3335(7)Å   c=15.5664(8)Å

α=102.8610(10)°   β=98.7200(10)°   γ=101.1810(10)°

C20H18N2O2

C20H18N2O2

Liana WongChunhua HuRuthanne ParadiseZina ZhuAlexander ShtukenbergBart Kahr

Journal of the American Chemical Society (2012) 134, 12245-12251

a=22.808(7)Å   b=27.255(8)Å   c=4.9139(14)Å

α=90.00°   β=90.00°   γ=90.00°

C18H20N2O8,C10H10N2

C18H20N2O8,C10H10N2

Blackburn, Anthea K.Sue, Andrew C.-H.Shveyd, Alexander K.Cao, DennisTayi, AlokNarayanan, AshwinRolczynski, Brian S.Szarko, Jodi M.Bozdemir, Ozgur A.Wakabayashi, RieLehrman, Jessica A.Kahr, BartChen, Lin X.Nassar, Majed S.Stupp, Samuel I.Stoddart, J. Fraser

Journal of the American Chemical Society (2014) 141124065827003

a=9.5063(4)Å   b=12.1715(6)Å   c=12.8872(6)Å

α=61.896(3)°   β=89.095(3)°   γ=76.689(3)°

C18H20N2O8,0.5(C10H8O2)

C18H20N2O8,0.5(C10H8O2)

Blackburn, Anthea K.Sue, Andrew C.-H.Shveyd, Alexander K.Cao, DennisTayi, AlokNarayanan, AshwinRolczynski, Brian S.Szarko, Jodi M.Bozdemir, Ozgur A.Wakabayashi, RieLehrman, Jessica A.Kahr, BartChen, Lin X.Nassar, Majed S.Stupp, Samuel I.Stoddart, J. Fraser

Journal of the American Chemical Society (2014) 141124065827003

a=6.78680(10)Å   b=10.8904(2)Å   c=15.7778(2)Å

α=70.8800(10)°   β=81.5540(10)°   γ=83.1560(10)°

C18H26N2O4,C12H4N4

C18H26N2O4,C12H4N4

Blackburn, Anthea K.Sue, Andrew C.-H.Shveyd, Alexander K.Cao, DennisTayi, AlokNarayanan, AshwinRolczynski, Brian S.Szarko, Jodi M.Bozdemir, Ozgur A.Wakabayashi, RieLehrman, Jessica A.Kahr, BartChen, Lin X.Nassar, Majed S.Stupp, Samuel I.Stoddart, J. Fraser

Journal of the American Chemical Society (2014) 141124065827003

a=6.8961(2)Å   b=8.0293(3)Å   c=12.3435(4)Å

α=89.2130(10)°   β=83.730(2)°   γ=73.487(2)°

2(C18H20N2O8),C10H9NO

2(C18H20N2O8),C10H9NO

Blackburn, Anthea K.Sue, Andrew C.-H.Shveyd, Alexander K.Cao, DennisTayi, AlokNarayanan, AshwinRolczynski, Brian S.Szarko, Jodi M.Bozdemir, Ozgur A.Wakabayashi, RieLehrman, Jessica A.Kahr, BartChen, Lin X.Nassar, Majed S.Stupp, Samuel I.Stoddart, J. Fraser

Journal of the American Chemical Society (2014) 141124065827003

a=6.7603(7)Å   b=10.8522(11)Å   c=15.785(2)Å

α=71.882(9)°   β=81.810(9)°   γ=84.105(8)°

C16H11N,2(C11H11NO4)

C16H11N,2(C11H11NO4)

Blackburn, Anthea K.Sue, Andrew C.-H.Shveyd, Alexander K.Cao, DennisTayi, AlokNarayanan, AshwinRolczynski, Brian S.Szarko, Jodi M.Bozdemir, Ozgur A.Wakabayashi, RieLehrman, Jessica A.Kahr, BartChen, Lin X.Nassar, Majed S.Stupp, Samuel I.Stoddart, J. Fraser

Journal of the American Chemical Society (2014) 141124065827003

a=10.9811(8)Å   b=12.4287(8)Å   c=12.9441(9)Å

α=94.620(5)°   β=112.518(5)°   γ=109.840(5)°

C14H9Cl3F2

C14H9Cl3F2

Zhu, XiaolongHu, Chunhua T.Yang, JingxiangJoyce, Leo A.Qiu, MengdiWard, Michael D.Kahr, Bart

Journal of the American Chemical Society (2019) 141, 42 16858-16864

a=9.3017(11)Å   b=13.2943(15)Å   c=10.9353(13)Å

α=90°   β=97.406(2)°   γ=90°

C14H9Cl4F

C14H9Cl4F

Zhu, XiaolongHu, Chunhua T.Yang, JingxiangJoyce, Leo A.Qiu, MengdiWard, Michael D.Kahr, Bart

Journal of the American Chemical Society (2019) 141, 42 16858-16864

a=9.9230(6)Å   b=7.8080(5)Å   c=18.1832(11)Å

α=90°   β=94.5070(10)°   γ=90°

C14H9Cl4F

C14H9Cl4F

Zhu, XiaolongHu, Chunhua T.Yang, JingxiangJoyce, Leo A.Qiu, MengdiWard, Michael D.Kahr, Bart

Journal of the American Chemical Society (2019) 141, 42 16858-16864

a=9.9215(7)Å   b=7.8098(5)Å   c=18.1864(12)Å

α=90°   β=94.5070(10)°   γ=90°

C14H9Cl3F2

C14H9Cl3F2

Zhu, XiaolongHu, Chunhua T.Yang, JingxiangJoyce, Leo A.Qiu, MengdiWard, Michael D.Kahr, Bart

Journal of the American Chemical Society (2019) 141, 42 16858-16864

a=7.8711(13)Å   b=34.698(6)Å   c=20.060(3)Å

α=90°   β=99.450(3)°   γ=90°

C14H9Cl4F

C14H9Cl4F

Zhu, XiaolongHu, Chunhua T.Yang, JingxiangJoyce, Leo A.Qiu, MengdiWard, Michael D.Kahr, Bart

Journal of the American Chemical Society (2019) 141, 42 16858-16864

a=9.6421(5)Å   b=9.6762(5)Å   c=16.3543(9)Å

α=94.2960(10)°   β=103.0250(10)°   γ=107.2530(10)°

C14H9Cl4F

C14H9Cl4F

Zhu, XiaolongHu, Chunhua T.Yang, JingxiangJoyce, Leo A.Qiu, MengdiWard, Michael D.Kahr, Bart

Journal of the American Chemical Society (2019) 141, 42 16858-16864

a=9.881(6)Å   b=7.799(5)Å   c=36.55(2)Å

α=90°   β=90°   γ=90°

C16H18N4O3

C16H18N4O3

Nath, Naba K.Pejov, LjupčoNichols, Shane M.Hu, ChunhuaSaleh, Na'ilKahr, BartNaumov, Panče

Journal of the American Chemical Society (2014) 136, 7 2757-2766

a=10.152(2)Å   b=7.7688(17)Å   c=38.639(8)Å

α=90.00°   β=92.863(3)°   γ=90.00°

C8FN2O20Si10

C8FN2O20Si10

Alex RojasOriol ArteagaBart KahrMiguel A. Camblor

Journal of the American Chemical Society (2013) 135, 11975-11984

a=11.90205(11)Å   b=11.90205Å   c=29.6920(4)Å

α=90.0°   β=90.0°   γ=120.0°

Dihyanthraquin_P41_LT

C14H8O4

Rohl, Andrew L.Moret, MassimoKaminsky, WernerClaborn, KaceyMcKinnon, Joshua J.Kahr, Bart

Crystal Growth & Design (2008) 8, 12 4517

a=5.7230(3)Å   b=5.7230(3)Å   c=30.923(2)Å

α=90.00°   β=90.00°   γ=90.00°

Dihyanthraquin_P41_RT-Polymorph1

C14H8O4

Rohl, Andrew L.Moret, MassimoKaminsky, WernerClaborn, KaceyMcKinnon, Joshua J.Kahr, Bart

Crystal Growth & Design (2008) 8, 12 4517

a=5.746(3)Å   b=5.746(3)Å   c=31.39(5)Å

α=90.00°   β=90.00°   γ=90.00°

Dihyanthraquin_P21/n_LT

C14H8O4

Rohl, Andrew L.Moret, MassimoKaminsky, WernerClaborn, KaceyMcKinnon, Joshua J.Kahr, Bart

Crystal Growth & Design (2008) 8, 12 4517

a=7.2930(5)Å   b=9.5001(7)Å   c=14.7208(11)Å

α=90.00°   β=91.634(2)°   γ=90.00°

Dihyanthraquin_P41_LT-Polymorph5

C14H8O4

Rohl, Andrew L.Moret, MassimoKaminsky, WernerClaborn, KaceyMcKinnon, Joshua J.Kahr, Bart

Crystal Growth & Design (2008) 8, 12 4517

a=5.7140(16)Å   b=5.7140(16)Å   c=30.845(14)Å

α=90.00°   β=90.00°   γ=90.00°

Dihyanthraquin_meta_LT

C14H8O4

Rohl, Andrew L.Moret, MassimoKaminsky, WernerClaborn, KaceyMcKinnon, Joshua J.Kahr, Bart

Crystal Growth & Design (2008) 8, 12 4517

a=21.578(2)Å   b=3.7660(16)Å   c=24.683(2)Å

α=90.00°   β=90.00°   γ=90.00°

Dihyanthraquin_Pb1_LT

C14H8O4

Rohl, Andrew L.Moret, MassimoKaminsky, WernerClaborn, KaceyMcKinnon, Joshua J.Kahr, Bart

Crystal Growth & Design (2008) 8, 12 4517

a=10.2110(15)Å   b=10.3080(15)Å   c=19.776(3)Å

α=78.058(8)°   β=83.905(9)°   γ=88.995(11)°

Dihyanthraquin_P41212_RT

C14H8O4

Rohl, Andrew L.Moret, MassimoKaminsky, WernerClaborn, KaceyMcKinnon, Joshua J.Kahr, Bart

Crystal Growth & Design (2008) 8, 12 4517

a=5.7486(6)Å   b=5.7486(6)Å   c=31.437(5)Å

α=90.00°   β=90.00°   γ=90.00°

Meconic acid

C7H4O7*3H2O

Scott LovellParamjeet SubramonyBart Kahr

Journal of the American Chemical Society (1999) 121, 7020-7025

a=15.9821(4)Å   b=6.3658(1)Å   c=19.6955(5)Å

α=90°   β=90°   γ=90°

Meconic acid

C7H4O7*3H2O

Scott LovellParamjeet SubramonyBart Kahr

Journal of the American Chemical Society (1999) 121, 7020-7025

a=12.2591(6)Å   b=9.8938(5)Å   c=16.2499(4)Å

α=90.00°   β=95.7910(3)°   γ=90.00°

C10H10N2,C22H22N2O8

C10H10N2,C22H22N2O8

Blackburn, Anthea K.Sue, Andrew C.-H.Shveyd, Alexander K.Cao, DennisTayi, AlokNarayanan, AshwinRolczynski, Brian S.Szarko, Jodi M.Bozdemir, Ozgur A.Wakabayashi, RieLehrman, Jessica A.Kahr, BartChen, Lin X.Nassar, Majed S.Stupp, Samuel I.Stoddart, J. Fraser

Journal of the American Chemical Society (2014) 141124065827003

a=6.9510(2)Å   b=8.6966(2)Å   c=12.1281(3)Å

α=72.093(2)°   β=76.054(2)°   γ=80.941(2)°

C14H9Cl4F

C14H9Cl4F

Zhu, XiaolongHu, Chunhua T.Yang, JingxiangJoyce, Leo A.Qiu, MengdiWard, Michael D.Kahr, Bart

Journal of the American Chemical Society (2019) 141, 42 16858-16864

a=7.862(3)Å   b=34.467(13)Å   c=21.043(8)Å

α=90°   β=99.217(3)°   γ=90°

C11H16ClNO2

C11H16ClNO2

Morimoto, Bruce H.Lovell, ScottKahr, Bart

Acta Crystallographica Section C (1998) 54, 2 229-231

a=9.3482(2)Å   b=7.0493(3)Å   c=18.0924(7)Å

α=90°   β=90°   γ=90°