Structures published

Total: 256

1-[(4-Fluorophenyl)(methyl)amino]-3,4,5,6-tetrahydroxyhexan-2-one

C₁₃H₁₈FNO₅

Mossine, Valeri V.Barnes, Charles L.Mawhinney, Thomas P.

IUCrData (2018) 3, 3 x180369

a=10.561(6)Å b=5.156(3)Å c=12.504(7)Å

α=90° β=90.606(9)° γ=90°

C₁₅H₁₄O₂Se

Topinka, Michael Zawatzky, Kerstin Barnes, Charles L.Welch, Christopher J.Harmata, Michael

Organic letters (2017) 19, 15 4106-4109

a=5.9869(2)Å b=10.9322(4)Å c=19.3709(7)Å

α=90° β=90° γ=90°

C₁₉H₂₃NO₃S

Harmata, Michael Hong, Xuechuan Barnes, Charles L.

Organic letters (2004) 6, 13 2201-2203

a=9.1575(4)Å b=9.1575(4)Å c=17.9200(15)Å

α=90.00° β=90.00° γ=120.00°

C₂₄H₂₉NO₂S

Harmata, Michael Hong, Xuechuan Barnes, Charles L.

Organic letters (2004) 6, 13 2201-2203

a=5.4679(9)Å b=8.3878(13)Å c=45.772(7)Å

α=90.00° β=90.00° γ=90.00°

C₂₀H₁₄N₃O₇Re_,0.5(C₄H₈O₂)

Kasten, Benjamin B.Ma, Xiaowei Liu, Hongguang Hayes, Thomas R.Barnes, Charles L.Qi, Shibo Cheng, Kai Bottorff, Shalina C.Slocumb, Winston S.Wang, Jing Cheng, Zhen Benny, Paul D.

Bioconjugate chemistry (2014) 25, 3 579-592

a=8.3712(11)Å b=14.8036(19)Å c=18.193(2)Å

α=90.00° β=90.475(2)° γ=90.00°

C₁₃H₁₂F₃N₂O₅ReS

Jiang, Han Kasten, Benjamin B.Liu, Hongguang Qi, Shibo Liu, Yang Tian, Mei Barnes, Charles L.Zhang, Hong Cheng, Zhen Benny, Paul D.

Bioconjugate chemistry (2012) 23, 11 2300-2312

a=8.4168(9)Å b=18.993(2)Å c=11.4760(12)Å

α=90.00° β=110.1880(10)° γ=90.00°

C₃₆H₄₅NO₅S

Harmata, Michael Chen, Yugang Barnes, Charles L.

Organic letters (2007) 9, 23 4701-4704

a=12.5267(10)Å b=12.6609(10)Å c=21.3678(17)Å

α=90.00° β=90.00° γ=90.00°

C₄₆H₅₄N₂O₇S₂

Harmata, Michael Chen, Yugang Barnes, Charles L.

Organic letters (2007) 9, 23 4701-4704

a=15.0309(4)Å b=15.0309(4)Å c=37.985(2)Å

α=90.00° β=90.00° γ=90.00°

C₂₅H₃₂N₂O₄S

Harmata, Michael Chen, Yugang Barnes, Charles L.

Organic letters (2007) 9, 23 4701-4704

a=14.267(3)Å b=7.6190(16)Å c=34.013(7)Å

α=90.00° β=91.388(4)° γ=90.00°

C₁₆H₂₁ClO₂

Harmata, Michael Lee, Dong Reyoul Barnes, Charles L.

Organic letters (2005) 7, 9 1881-1883

a=11.7815(7)Å b=10.3316(6)Å c=12.8152(8)Å

α=90.00° β=114.1460(10)° γ=90.00°

C₁₇H₂₃ClO₂

Harmata, Michael Lee, Dong Reyoul Barnes, Charles L.

Organic letters (2005) 7, 9 1881-1883

a=7.5148(7)Å b=21.084(2)Å c=10.2821(10)Å

α=90.00° β=108.583(2)° γ=90.00°

C₁₂H₁₃N₅O₂

Loeppky, Richard N.Shi, Jianzheng Barnes, Charles L.Geddam, Sailaja

Chemical research in toxicology (2008) 21, 2 295-307

a=16.0664(16)Å b=37.184(4)Å c=9.0903(9)Å

α=90.00° β=90.00° γ=90.00°

C₁₀H₁₂BrN₃O

Loeppky, Richard N.Shi, Jianzheng Barnes, Charles L.Geddam, Sailaja

Chemical research in toxicology (2008) 21, 2 295-307

a=8.9232(6)Å b=10.3244(7)Å c=12.4802(8)Å

α=90.00° β=90.00° γ=90.00°

C₁₈H₁₆N₄O₃

Loeppky, Richard N.Shi, Jianzheng Barnes, Charles L.Geddam, Sailaja

Chemical research in toxicology (2008) 21, 2 295-307

a=8.9484(16)Å b=13.398(2)Å c=14.421(3)Å

α=90.00° β=90.00° γ=90.00°

C₁₀H₉NO₃

Loeppky, Richard N.Shi, Jianzheng Barnes, Charles L.Geddam, Sailaja

Chemical research in toxicology (2008) 21, 2 295-307

a=6.6394(5)Å b=9.5228(7)Å c=14.3291(11)Å

α=87.7820(10)° β=89.9770(10)° γ=89.7630(10)°

Trans-[Re(PEt3)2(sal2en)][PF6]

C₂₈H₄₄N₂O₂P₂Re_,F₆P

Baumeister, Jakob E.Mitchell, Andrew W.Kelley, Steven P.Barnes, Charles L.Jurisson, Silvia S.

Dalton transactions (Cambridge, England : 2003) (2019) 48, 34 12943-12955

a=10.4621(14)Å b=15.724(2)Å c=19.766(3)Å

α=90° β=98.111(3)° γ=90°

Cis-[ReO(PEtPh2) (sal2ibn)][PF6]

C₂₈H₃₃N₂O₃P₁Re_,PF₆

Baumeister, Jakob E.Mitchell, Andrew W.Kelley, Steven P.Barnes, Charles L.Jurisson, Silvia S.

Dalton transactions (Cambridge, England : 2003) (2019) 48, 34 12943-12955

a=10.7455(9)Å b=12.2922(11)Å c=13.3527(12)Å

α=65.5840(10)° β=70.2510(10)° γ=83.0920(10)°

C₃₆H₃₃N₂O₃PRe_,F₆P

Baumeister, Jakob E.Mitchell, Andrew W.Kelley, Steven P.Barnes, Charles L.Jurisson, Silvia S.

Dalton transactions (Cambridge, England : 2003) (2019) 48, 34 12943-12955

a=11.6943(14)Å b=13.5357(15)Å c=13.6568(16)Å

α=68.440(3)° β=70.666(4)° γ=64.490(4)°

C₄₆H₄₈N₂O₂P₂Re_,F₆P

Baumeister, Jakob E.Mitchell, Andrew W.Kelley, Steven P.Barnes, Charles L.Jurisson, Silvia S.

Dalton transactions (Cambridge, England : 2003) (2019) 48, 34 12943-12955

a=42.450(4)Å b=10.1296(9)Å c=30.348(3)Å

α=90° β=130.2840(10)° γ=90°

Cis-[ReO(PEtPh2) (sal2ibn)][PF6]

C₃₂H₃₃N₂O₃P₁Re_,F₆P

Baumeister, Jakob E.Mitchell, Andrew W.Kelley, Steven P.Barnes, Charles L.Jurisson, Silvia S.

Dalton transactions (Cambridge, England : 2003) (2019) 48, 34 12943-12955

a=9.3266(11)Å b=19.497(2)Å c=17.659(2)Å

α=90° β=94.463(2)° γ=90°

C₄₄H₄₄N₂O₂P₂Re_,Cl

Baumeister, Jakob E.Mitchell, Andrew W.Kelley, Steven P.Barnes, Charles L.Jurisson, Silvia S.

Dalton transactions (Cambridge, England : 2003) (2019) 48, 34 12943-12955

a=10.5691(6)Å b=12.4434(8)Å c=17.0828(10)Å

α=100.0420(10)° β=91.4370(10)° γ=106.1440(10)°

Trans-[Re(PEt3)2(sal2ibn)][PF6]

C₃₀H₄₈N₂O₂P₂Re_,PF₆

Baumeister, Jakob E.Mitchell, Andrew W.Kelley, Steven P.Barnes, Charles L.Jurisson, Silvia S.

Dalton transactions (Cambridge, England : 2003) (2019) 48, 34 12943-12955

a=23.1732(18)Å b=15.5470(12)Å c=21.3236(17)Å

α=90° β=117.1330(10)° γ=90°

C₂₄H₃₃N₂O₃PRe_,F₆P

Baumeister, Jakob E.Mitchell, Andrew W.Kelley, Steven P.Barnes, Charles L.Jurisson, Silvia S.

Dalton transactions (Cambridge, England : 2003) (2019) 48, 34 12943-12955

a=8.7506(3)Å b=10.9321(4)Å c=29.4316(11)Å

α=90° β=90.9445(12)° γ=90°

C₂₇H₃₆N₃U

Behrle, Andrew C.Myers, Alexander J.Rungthanaphatsophon, Pokpong Lukens, Wayne W.Barnes, Charles L.Walensky, Justin R.

Chemical communications (Cambridge, England) (2016) 52, 100 14373-14375

a=14.318(2)Å b=11.5400(17)Å c=14.975(2)Å

α=90° β=93.520(2)° γ=90°

C₂₇H₃₅Cl₀N₃Th

Behrle, Andrew C.Myers, Alexander J.Rungthanaphatsophon, Pokpong Lukens, Wayne W.Barnes, Charles L.Walensky, Justin R.

Chemical communications (Cambridge, England) (2016) 52, 100 14373-14375

a=9.590(2)Å b=11.143(2)Å c=11.619(2)Å

α=88.275(2)° β=77.613(2)° γ=87.316(2)°

C₁₀₄H₁₀₈OS₈Th_,C₇H₈

Behrle, Andrew C.Myers, Alexander J.Rungthanaphatsophon, Pokpong Lukens, Wayne W.Barnes, Charles L.Walensky, Justin R.

Chemical communications (Cambridge, England) (2016) 52, 100 14373-14375

a=14.983(6)Å b=25.115(11)Å c=27.353(12)Å

α=90° β=92.488(6)° γ=90°

C₁₀₄H₁₀₈OS₈U_,2(C₇H₈)

Behrle, Andrew C.Myers, Alexander J.Rungthanaphatsophon, Pokpong Lukens, Wayne W.Barnes, Charles L.Walensky, Justin R.

Chemical communications (Cambridge, England) (2016) 52, 100 14373-14375

a=15.0040(12)Å b=25.0884(19)Å c=27.253(2)Å

α=90° β=92.5270(10)° γ=90°

P3R1C4, Zn, DMF, H2O

C₃₀₀H₃₅₄N₁₂O₈₆Zn₁₈

Zhang, Chen Sikligar, Kanishka Patil, Rahul S.Barnes, Charles L.Baker, Gary A.Atwood, Jerry L.

Chemical communications (Cambridge, England) (2018) 54, 6 635-637

a=27.2432(17)Å b=36.6460(18)Å c=21.3526(11)Å

α=90° β=117.492(2)° γ=90°

P3R1C4, Co, py, NO3

C₁₂₉H₁₂₅Co₇N₁₀O₃₁

Zhang, Chen Sikligar, Kanishka Patil, Rahul S.Barnes, Charles L.Teat, Simon Atwood, Jerry L.

Chem. Commun. (2017)

a=29.060(7)Å b=25.535(6)Å c=17.029(5)Å

α=90° β=93.26(2)° γ=90°

P3R1C3, Zn, py, NO3

C₁₂₃H₁₀₉N₉O₂₈Zn₇

Zhang, Chen Sikligar, Kanishka Patil, Rahul S.Barnes, Charles L.Teat, Simon Atwood, Jerry L.

Chem. Commun. (2017)

a=28.6437(12)Å b=25.8870(10)Å c=16.8049(6)Å

α=90° β=90.588(2)° γ=90°

PgC4, Pro, DMF, Mg

C₃₀₆H₃₄₂Mg₂₄N₁₀O₁₁₆

Zhang, Chen Patil, Rahul S.Barnes, Charles L.Atwood, Jerry L.

Chem. Commun. (2017)

a=28.261(6)Å b=36.059(7)Å c=21.798(4)Å

α=90.00(3)° β=117.95(3)° γ=90.00(3)°

PgC3OH, Pro, DMF, Mg

C₂₇₆H₂₅₈Mg₂₄N₈O₁₄₀

Zhang, Chen Patil, Rahul S.Barnes, Charles L.Atwood, Jerry L.

Chem. Commun. (2017)

a=28.8873(12)Å b=35.5602(13)Å c=21.8751(9)Å

α=90° β=118.990(2)° γ=90°

PgC3, Pro, DMF, Mg

6(C₄₀H₃₆O₁₂)₆(C₅H₉NO₂)₂(C₃H₆NO)₃₀O₂₄Mg

Zhang, Chen Patil, Rahul S.Barnes, Charles L.Atwood, Jerry L.

Chem. Commun. (2017)

a=28.6297(8)Å b=35.3408(10)Å c=21.5450(6)Å

α=90° β=119.007(2)° γ=90°

C₁₂H₈BrCuN₂

Bosch, Eric Barnes, Charles L.

New Journal of Chemistry (2001) 25, 11 1376

a=7.2313(12)Å b=8.9917(15)Å c=9.4175(16)Å

α=84.667(3)° β=81.705(3)° γ=73.315(3)°

C₁₂H₈BrCuN₂

Bosch, Eric Barnes, Charles L.

New Journal of Chemistry (2001) 25, 11 1376

a=8.5820(7)Å b=17.6497(13)Å c=7.3216(6)Å

α=90.00° β=91.720(2)° γ=90.00°

C_345.28H_450.21N₄O_74.72

Whetstine, Jena L.Kline, Katrina K.Fowler, Drew A.Ragan, Cheryl M.Barnes, Charles L.Atwood, Jerry L.Tucker, Sheryl A.

New Journal of Chemistry (2010) 34, 11 2587

a=19.5278(6)Å b=22.6384(7)Å c=23.5862(7)Å

α=69.145(2)° β=69.485(2)° γ=71.748(2)°

C₄₀H₄₀O₁₆

Maerz, Andrew K.Fowler, Drew A.Mossine, Andrew V.Mistry, Miten Kumari, Harshita Barnes, Charles L.Deakyne, Carol A.Atwood, Jerry L.

New Journal of Chemistry (2011) 35, 4 784

a=10.940(5)Å b=12.189(5)Å c=17.454(10)Å

α=78.497(6)° β=87.202(7)° γ=84.105(4)°

C₄₇H₅₈O_14.4

Maerz, Andrew K.Fowler, Drew A.Mossine, Andrew V.Mistry, Miten Kumari, Harshita Barnes, Charles L.Deakyne, Carol A.Atwood, Jerry L.

New Journal of Chemistry (2011) 35, 4 784

a=39.531(7)Å b=10.5545(18)Å c=23.913(4)Å

α=90.00° β=111.845(2)° γ=90.00°

PGC4GaCd

C₂₇₀H₄₅₂Cd₃Ga₁₇N₄O₁₅₂

Ping Jin Harshita Kumari Stuart Kennedy Charles L. Barnes Simon J. Teat Scott J. Dalgarno Jerry L. Atwood

Chem.Commun. (2014) 50, 4508

a=32.6322(13)Å b=27.6208(11)Å c=44.2453(17)Å

α=90° β=97.087(2)° γ=90°

PgC3, bpa, Toluene, MeCN

C₄₀H₄₈O_12,2(C₁₂H₈N₂)_,C₇H_8,C₂H₃N₁

Patil, Rahul S.Kumari, Harshita Barnes, Charles L.Atwood, Jerry L.

Chemical communications (Cambridge, England) (2015) 51, 12 2304-2307

a=23.451(4)Å b=16.433(3)Å c=16.899(3)Å

α=90.00° β=90.00° γ=90.00°

PgC1, bpy, MeCN

C₈H₈O_3,C₁₀H₈N_2,1.75C_,0.5N

Patil, Rahul S.Kumari, Harshita Barnes, Charles L.Atwood, Jerry L.

Chemical communications (Cambridge, England) (2015) 51, 12 2304-2307

a=21.6686(8)Å b=21.6686(8)Å c=15.3857(7)Å

α=90.00° β=90.00° γ=90.00°

PgC3, bpy, MeCN

C₄₀H₄₈O_12,2(C₁₀H₈N_20,C₂H₃N

Patil, Rahul S.Kumari, Harshita Barnes, Charles L.Atwood, Jerry L.

Chemical communications (Cambridge, England) (2015) 51, 12 2304-2307

a=21.1314(15)Å b=15.2280(11)Å c=18.2607(13)Å

α=90° β=110.1330(10)° γ=90°

PgC3, bpa, Acetone, MeCN

C₃₂H₃₂O_12,4(C₁₂H₈N₂)_,C₂H₃N_,C₃H₆O

Patil, Rahul S.Kumari, Harshita Barnes, Charles L.Atwood, Jerry L.

Chemical communications (Cambridge, England) (2015) 51, 12 2304-2307

a=20.8301(9)Å b=12.6507(6)Å c=29.0453(13)Å

α=90° β=107.332(2)° γ=90°

PgC3, DMF, Mg

6(C₄₀H₃₆O₁₂)₄(C₃H₆NO)₄₄O₂₄Mg

Zhang, Chen Patil, Rahul S.Li, Tao Barnes, Charles L.Atwood, Jerry L.

Chemical communications (Cambridge, England) (2017) 53, 31 4312-4314

a=28.2464(14)Å b=35.3404(15)Å c=21.6242(10)Å

α=90° β=118.889(2)° γ=90°

C₂₅₀H₂₂₆Mg₂₄N₂O₁₂₀

Zhang, Chen Patil, Rahul S.Li, Tao Barnes, Charles L.Atwood, Jerry L.

Chemical communications (Cambridge, England) (2017) 53, 31 4312-4314

a=26.113(2)Å b=26.276(2)Å c=27.960(2)Å

α=93.634(4)° β=92.074(5)° γ=90.160(5)°

(E,E)-1,2-bis-4-chlorobenzaldazine

C₁₄H₁₀Cl₂N₂

Glaser, Rainer Murphy, Richard F.Sui, Yongqiang Barnes, Charles L.Kim, Sung Hoon

CrystEngComm (2006) 8, 5 372

a=3.8917(5)Å b=6.9999(8)Å c=22.977(3)Å

α=90.00° β=90.798(2)° γ=90.00°

Alpha-oximino(N-methyl-2-benzimidazolyl)-acetonitrile

C₁₀H₈N₄O_,H₂O

Ilkun, Olesya T.Archibald, Stephen J.Barnes, Charles L.Gerasimchuk, Nikolay Biagioni, Richard Silchenko, Svitlana Gerasimchuk, Olga A.Nemykin, Victor N.

Dalton Transactions (2008) 42 5715-5729

a=7.1446(18)Å b=8.587(2)Å c=8.988(2)Å

α=96.67(2)° β=109.370(18)° γ=99.79(2)°

Alfa-Oximino(2-benzoxazolyl)-acetonitrile

C₉H₆N₃O_2,C₉H₄N₃O₂

Ilkun, Olesya T.Archibald, Stephen J.Barnes, Charles L.Gerasimchuk, Nikolay Biagioni, Richard Silchenko, Svitlana Gerasimchuk, Olga A.Nemykin, Victor N.

Dalton Transactions (2008) 42 5715-5729

a=14.1723(19)Å b=7.1591(10)Å c=17.461(2)Å

α=90.00° β=101.404(2)° γ=90.00°

Tl-BTCO

C₉H₄N₃OSTl

Ilkun, Olesya T.Archibald, Stephen J.Barnes, Charles L.Gerasimchuk, Nikolay Biagioni, Richard Silchenko, Svitlana Gerasimchuk, Olga A.Nemykin, Victor N.

Dalton Transactions (2008) 42 5715-5729

a=14.8621(17)Å b=4.4277(3)Å c=15.0453(15)Å

α=90.00° β=90.150(9)° γ=90.00°

C₁₃₉H₁₅₅N₇O₂₆Zn₈

Kumari, Harshita Mayhan, Collin M.Barnes, Charles L.Deakyne, Carol A.Atwood, Jerry L.

CrystEngComm (2016) 18, 26 4909

a=17.042(10)Å b=19.312(11)Å c=25.505(15)Å

α=111.723(8)° β=93.518(8)° γ=102.470(8)°

C₃₆H₅₈OPSiU

Rungthanaphatsophon, Pokpong Barnes, Charles L.Kelley, Steven P.Walensky, Justin R.

Dalton transactions (Cambridge, England : 2003) (2018) 47, 25 8189-8192

a=9.6794(5)Å b=20.3019(12)Å c=18.3009(11)Å

α=90° β=97.346(2)° γ=90°

C₇₈H₁₁₇N₆U_3,0.5(C₅)

Rungthanaphatsophon, Pokpong Barnes, Charles L.Kelley, Steven P.Walensky, Justin R.

Dalton transactions (Cambridge, England : 2003) (2018) 47, 25 8189-8192

a=18.8226(9)Å b=23.0418(10)Å c=19.0030(9)Å

α=90° β=90° γ=90°

C₂₆H₄₈N₂Si₂U

Rungthanaphatsophon, Pokpong Barnes, Charles L.Kelley, Steven P.Walensky, Justin R.

Dalton transactions (Cambridge, England : 2003) (2018) 47, 25 8189-8192

a=13.2573(14)Å b=14.8359(16)Å c=15.4478(17)Å

α=90.00° β=90.00° γ=90.00°