Crystal Structures List

C₂₀H₁₉O₃P

Zhang, Dong Celaje, Jeff A.Agua, Alon Doan, Chad Stewart, Timothy Bau, Robert Selke, Matthias

Organic letters (2010) 12, 13 3100-3103

a=9.336(2)Å b=12.036(3)Å c=15.354(4)Å

α=90.00° β=101.625(4)° γ=90.00°

C₇₂H₅₀Fe₂O₂

Morisaki, Yasuhiro Sawamura, Toshiyuki Murakami, Takuya Chujo, Yoshiki

Organic letters (2010) 12, 14 3188-3191

a=14.141(2)Å b=10.6057(17)Å c=18.010(3)Å

α=90.00° β=109.354(7)° γ=90.00°

(3R,3aS,3a1R,4S,6aR,9aS)-tert-butyl 4-(3,5-dimethoxyphenyl)-9a-hydroxy- 3-methyl-2,3,3a,3a1,4,6a,7,8,9,9a-decahydro-1H-benzo[de]quinoline-1-carboxylate

C₂₆H₃₇NO₅

Burke, Jason P.Sabat, Michal Iovan, Diana A.Myers, William H.Chruma, Jason J.

Organic letters (2010) 12, 14 3192-3195

a=16.5169(9)Å b=5.7641(3)Å c=50.954(3)Å

α=90.00° β=90.00° γ=90.00°

C₁₆H₂₀N₄O₇

Medeiros, Matthew R.Narayan, Radha S.McDougal, Nolan T.Schaus, Scott E.Porco, Jr, John A

Organic letters (2010) 12, 14 3222-3225

a=9.757(8)Å b=29.99(2)Å c=11.970(9)Å

α=90.00° β=98.610(19)° γ=90.00°

Triazacalix[3]pyrrole

C₂₁H₃₂N₆O

Mani, Ganesan Jana, Debasish Kumar, Rajnish Ghorai, Debasish

Organic letters (2010) 12, 14 3212-3215

a=11.9147(15)Å b=20.442(3)Å c=18.076(2)Å

α=90.00° β=97.600(4)° γ=90.00°

Tetraazacalix[4]pyrrole(Methyl)

C₂₈H₄₂N₈O

Mani, Ganesan Jana, Debasish Kumar, Rajnish Ghorai, Debasish

Organic letters (2010) 12, 14 3212-3215

a=12.9325(18)Å b=14.0180(18)Å c=17.516(2)Å

α=90.00° β=109.805(4)° γ=90.00°

Tetraazacalix[4]pyrrole(Et)

C₃₂H₅₀N₈O

Mani, Ganesan Jana, Debasish Kumar, Rajnish Ghorai, Debasish

Organic letters (2010) 12, 14 3212-3215

a=17.429(3)Å b=13.793(2)Å c=15.399(2)Å

α=90.00° β=114.644(4)° γ=90.00°

In manuscript 8a

C₂₉H_27.33Cl_2.67N₂O₂

D'Souza, Daniel M Muschelknautz, Christian Rominger, Frank Müller, Thomas J J

Organic letters (2010) 12, 15 3364-3367

a=9.706(1)Å b=11.437(1)Å c=12.864(1)Å

α=92.632(2)° β=108.562(2)° γ=103.893(2)°

In manuscript 8k

C₄₀H₄₁N₃O₅S

D'Souza, Daniel M Muschelknautz, Christian Rominger, Frank Müller, Thomas J J

Organic letters (2010) 12, 15 3364-3367

a=19.1627(7)Å b=9.8124(4)Å c=19.8246(8)Å

α=90.00° β=97.0670(10)° γ=90.00°

In manuscript 8n

C₃₀H₂₉Cl₃N₂O₅S

D'Souza, Daniel M Muschelknautz, Christian Rominger, Frank Müller, Thomas J J

Organic letters (2010) 12, 15 3364-3367

a=9.8525(6)Å b=12.4298(8)Å c=13.0648(9)Å

α=71.504(1)° β=77.486(1)° γ=75.275(1)°

C₁₉H₂₀N₂O₅

Xu, Yingjie Matsunaga, Shigeki Shibasaki, Masakatsu

Organic letters (2010) 12, 14 3246-3249

a=9.6820(3)Å b=9.9137(4)Å c=19.0085(7)Å

α=90.0000° β=90.0000° γ=90.0000°

C₁₄H₁₅BrO

Yang, Hua Carter, Rich G.

Organic letters (2010) 12, 13 3108-3111

a=6.240(3)Å b=7.706(3)Å c=12.861(5)Å

α=90.00° β=98.015(7)° γ=90.00°

C₁₉H₁₇ClO

Yang, Hua Carter, Rich G.

Organic letters (2010) 12, 13 3108-3111

a=6.508(2)Å b=10.191(3)Å c=12.222(4)Å

α=91.608(6)° β=103.611(5)° γ=101.668(5)°

C₅₃H₅₂Cl₂N₂O₂P₂Ru

Arai, Noriyoshi Akashi, Masaya Sugizaki, Satoshi Ooka, Hirohito Inoue, Tsutomu Ohkuma, Takeshi

Organic letters (2010) 12, 15 3380-3383

a=10.8594(5)Å b=21.0813(8)Å c=23.1923(10)Å

α=90.0000° β=90.0000° γ=90.0000°

(C₁₁H₁₄BN₃O₂)₂(CHCl₃)

Ito, Hiroshi Yumura, Kyohei Saigo, Kazuhiko

Organic letters (2010) 12, 15 3386-3389

a=8.673(4)Å b=10.421(5)Å c=17.737(8)Å

α=100.899(5)° β=94.817(5)° γ=114.075(6)°

(C₁₂H₁₆BN₃O₂)₂

Ito, Hiroshi Yumura, Kyohei Saigo, Kazuhiko

Organic letters (2010) 12, 15 3386-3389

a=8.789(5)Å b=12.196(5)Å c=12.799(5)Å

α=83.320(5)° β=86.166(5)° γ=71.603(5)°

(C₁₂H₁₆BN₃O₂)(C₅H₇N₃)(CHCl₃)

Ito, Hiroshi Yumura, Kyohei Saigo, Kazuhiko

Organic letters (2010) 12, 15 3386-3389

a=8.135(4)Å b=11.106(5)Å c=14.144(6)Å

α=68.629(18)° β=74.897(19)° γ=77.76(2)°

C₁₃H₂₅Br₂InO₂

Nishimoto, Yoshihiro Ueda, Hiroki Inamoto, Yoshihiro Yasuda, Makoto Baba, Akio

Organic letters (2010) 12, 15 3390-3393

a=6.8758(4)Å b=10.8208(7)Å c=12.6521(6)Å

α=108.628(2)° β=94.419(2)° γ=101.340(2)°

C₂₂H₃₈Br₄In₂O₄

Nishimoto, Yoshihiro Ueda, Hiroki Inamoto, Yoshihiro Yasuda, Makoto Baba, Akio

Organic letters (2010) 12, 15 3390-3393

a=8.9488(5)Å b=17.4208(8)Å c=10.2343(6)Å

α=90.0000° β=110.248(2)° γ=90.0000°

C₁₇H₂₃NO

Nishimoto, Yoshihiro Ueda, Hiroki Inamoto, Yoshihiro Yasuda, Makoto Baba, Akio

Organic letters (2010) 12, 15 3390-3393

a=9.73374(19)Å b=10.3541(2)Å c=15.0615(3)Å

α=90.0000° β=82.3380(11)° γ=90.0000°

Guaianolide

C₁₅H₂₄O₃

Navickas, Vaidotas Ushakov, Dmitry B.Maier, Martin E.Ströbele, Markus Meyer, H-Jürgen

Organic letters (2010) 12, 15 3418-3421

a=7.387(1)Å b=11.854(1)Å c=15.835(2)Å

α=90.00° β=90.00° γ=90.00°

C₁₄H₁₆O₂

Butler, Jeffrey D.Conrad, Wayne E.Lodewyk, Michael W.Fettinger, James C.Tantillo, Dean J.Kurth, Mark J.

Organic letters (2010) 12, 15 3410-3413

a=11.6103(4)Å b=9.3464(3)Å c=21.5764(8)Å

α=90.00° β=104.9280(10)° γ=90.00°

C₁₆H₂₂O

Butler, Jeffrey D.Conrad, Wayne E.Lodewyk, Michael W.Fettinger, James C.Tantillo, Dean J.Kurth, Mark J.

Organic letters (2010) 12, 15 3410-3413

a=6.4749(2)Å b=8.5245(2)Å c=23.9058(6)Å

α=90.00° β=90.00° γ=90.00°

C₁₀H₆ClO₆PW

Mao, Yanli Mathey, Francois

Organic letters (2010) 12, 15 3384-3385

a=6.7284(11)Å b=19.087(3)Å c=10.4396(17)Å

α=90.00° β=94.175(9)° γ=90.00°

C₂₀H₁₂O₁₃P₂W₂

Mao, Yanli Mathey, Francois

Organic letters (2010) 12, 15 3384-3385

a=10.0533(4)Å b=10.6263(4)Å c=13.1213(5)Å

α=66.685(2)° β=78.9520(10)° γ=84.0210(10)°

C₂₅H₂₄F₆N₂O₃

Prosser, Anthony R.Banning, Joseph E.Rubina, Marina Rubin, Michael

Organic letters (2010) 12, 18 3968-3971

a=15.679(9)Å b=16.496(10)Å c=8.969(5)Å

α=90.00° β=95.185(11)° γ=90.00°

C₂₂H₂₂N₂O

Ignatenko, Vasily A.Deligonul, Nihal Viswanathan, Rajesh

Organic letters (2010) 12, 16 3594-3597

a=8.3995(11)Å b=12.2643(16)Å c=17.383(2)Å

α=90.00° β=90.00° γ=90.00°

C₃₂H₅₀N₂O₄

Yang, Yu-Rong Lai, Zeng-Wei Shen, Liang Huang, Jiu-Zhong Wu, Xing-De Yin, Jun-Lin Wei, Kun

Organic letters (2010) 12, 15 3430-3433

a=8.2499(9)Å b=8.2499(9)Å c=42.596(10)Å

α=90.00° β=90.00° γ=90.00°

C₁₆H₁₃BrO₂

Chen, Zhengwang Li, Jinghao Jiang, Huanfeng Zhu, Shifa Li, Yibiao Qi, Chaorong

Organic letters (2010) 12, 14 3262-3265

a=9.977(2)Å b=5.5033(11)Å c=13.198(3)Å

α=90.00° β=108.25(3)° γ=90.00°

C₄₄H₄₉NiOP

Ogoshi, Sensuke Nishimura, Akira Ohashi, Masato

Organic letters (2010) 12, 15 3450-3452

a=12.8408(5)Å b=15.1873(6)Å c=18.4530(9)Å

α=90.0000° β=97.9023(15)° γ=90.0000°

C₂₄H₂₆O₂

Ogoshi, Sensuke Nishimura, Akira Ohashi, Masato

Organic letters (2010) 12, 15 3450-3452

a=10.2808(3)Å b=15.2707(5)Å c=12.1045(4)Å

α=90.00° β=95.070(2)° γ=90.00°

C₂₄H₂₆O₂

Ogoshi, Sensuke Nishimura, Akira Ohashi, Masato

Organic letters (2010) 12, 15 3450-3452

a=6.08838(12)Å b=37.5923(7)Å c=9.11131(17)Å

α=90.0000° β=114.2711(12)° γ=90.0000°

2(C₄₆H₆₈N₈O₁₁)_,3(CHCl₃)

Fernandes, Carlos Faure, Sophie Pereira, Elisabeth Théry, Vincent Declerck, Valérie Guillot, Régis Aitken, David J.

Organic letters (2010) 12, 16 3606-3609

a=21.4551(14)Å b=28.4412(19)Å c=8.9866(6)Å

α=90.00° β=90.00° γ=90.00°

C₂₁H₁₂N₂O₂

Saha, Sukdeb Ghosh, Amrita Mahato, Prasenjit Mishra, Sandhya Mishra, Sanjiv K.Suresh, E.Das, Satyabrata Das, Amitava

Organic letters (2010) 12, 15 3406-3409

a=15.444(4)Å b=7.4809(17)Å c=14.862(3)Å

α=90.00° β=116.866(4)° γ=90.00°

C₂₅H₁₆FeN₂O₂

Saha, Sukdeb Ghosh, Amrita Mahato, Prasenjit Mishra, Sandhya Mishra, Sanjiv K.Suresh, E.Das, Satyabrata Das, Amitava

Organic letters (2010) 12, 15 3406-3409

a=27.672(5)Å b=10.248(2)Å c=13.417(3)Å

α=90.00° β=90.00° γ=90.00°

C₂₆H₂₂F₃NO₂S

Minami, Yasunori Kuniyasu, Hitoshi Sanagawa, Atsushi Kambe, Nobuaki

Organic letters (2010) 12, 17 3744-3747

a=15.2284(7)Å b=17.6487(8)Å c=17.8733(9)Å

α=90.00° β=90.00° γ=90.00°

C₂₆H₂₄O

Chen, Zili Zhang, Yu-Xin Wang, Ya-Hui Zhu, Li-Li Liu, Heng Li, Xiao-Xiao Guo, Lin

Organic letters (2010) 12, 15 3468-3471

a=12.393(3)Å b=5.8186(12)Å c=14.691(3)Å

α=90.00° β=111.21(3)° γ=90.00°

None

C₁₈H₂₀O₂

Valiulin, Roman A.Arisco, Teresa M.Kutateladze, Andrei G.

Organic letters (2010) 12, 15 3398-3401

a=23.7529(9)Å b=6.5856(3)Å c=17.3617(7)Å

α=90.00° β=90.515(2)° γ=90.00°

C₁₈H₂₀O₂

Valiulin, Roman A.Arisco, Teresa M.Kutateladze, Andrei G.

Organic letters (2010) 12, 15 3398-3401

a=23.8832(2)Å b=23.8832(2)Å c=6.32310(10)Å

α=90.00° β=90.00° γ=120.00°

1,3-chlorohydrine

C₁₂H₁₇ClO

Valiulin, Roman A.Arisco, Teresa M.Kutateladze, Andrei G.

Organic letters (2010) 12, 15 3398-3401

a=10.9259(15)Å b=11.4009(16)Å c=14.825(3)Å

α=100.201(8)° β=96.264(8)° γ=115.471(5)°

None

C₁₂H₁₇ClO

Valiulin, Roman A.Arisco, Teresa M.Kutateladze, Andrei G.

Organic letters (2010) 12, 15 3398-3401

a=22.0572(3)Å b=22.0572(3)Å c=11.2664(2)Å

α=90.00° β=90.00° γ=120.00°

None

C₁₃H₁₉ClO

Valiulin, Roman A.Arisco, Teresa M.Kutateladze, Andrei G.

Organic letters (2010) 12, 15 3398-3401

a=11.5914(7)Å b=14.8542(9)Å c=21.2577(12)Å

α=90.00° β=96.950(3)° γ=90.00°

Test

C₁₈H₂₁ClO₂

Valiulin, Roman A.Arisco, Teresa M.Kutateladze, Andrei G.

Organic letters (2010) 12, 15 3398-3401

a=19.5539(5)Å b=6.3547(2)Å c=12.0615(3)Å

α=90.00° β=100.778(2)° γ=90.00°

C₁₈H₂₁ClO₂

Valiulin, Roman A.Arisco, Teresa M.Kutateladze, Andrei G.

Organic letters (2010) 12, 15 3398-3401

a=18.9939(3)Å b=7.06720(10)Å c=21.2043(4)Å

α=90.00° β=90.00° γ=90.00°

Spirohemiacetal

C₁₈H₂₂O_1.50

Valiulin, Roman A.Arisco, Teresa M.Kutateladze, Andrei G.

Organic letters (2010) 12, 15 3398-3401

a=6.30570(10)Å b=10.07010(10)Å c=11.39970(10)Å

α=79.4580(10)° β=81.7370(10)° γ=77.0690(10)°

C₃₆H₅₅Cl₂NO₁₀

Igarashi, Yasuhiro Kim, Youngju In, Yasuko Ishida, Toshimasa Kan, Yukiko Fujita, Tsuyoshi Iwashita, Takashi Tabata, Hirokazu Onaka, Hiroyasu Furumai, Tamotsu

Organic letters (2010) 12, 15 3402-3405

a=10.613(3)Å b=10.756(3)Å c=33.591(8)Å

α=90.00° β=90.00° γ=90.00°

C₂₄H₂₃F₃O

Yang, Chun-Ming Jeganmohan, Masilamani Parthasarathy, Kanniyappan Cheng, Chien-Hong

Organic Letters (2010) 12, 16 3610-3613

a=9.5151(16)Å b=9.9721(17)Å c=10.8051(18)Å

α=86.882(2)° β=89.898(2)° γ=75.105(2)°

C₁₉H₂₀O₄

Yang, Chun-Ming Jeganmohan, Masilamani Parthasarathy, Kanniyappan Cheng, Chien-Hong

Organic Letters (2010) 12, 16 3610-3613

a=5.35650(10)Å b=7.6392(2)Å c=10.0990(2)Å

α=76.0680(10)° β=85.2700(10)° γ=86.3380(10)°

C₁₁H₅ClFO₂

Colquhoun, Howard M.Zhu, Zhixue Cardin, Christine J.White, Andrew J. P.Drew, Michael G. B.Gan, Yu

Organic letters (2010) 12, 17 3756-3759

a=13.0998(2)Å b=6.05710(10)Å c=11.60960(10)Å

α=90.00° β=98.5140(10)° γ=90.00°

C₅₈H₃₄F₂O₄

Colquhoun, Howard M.Zhu, Zhixue Cardin, Christine J.White, Andrew J. P.Drew, Michael G. B.Gan, Yu

Organic letters (2010) 12, 17 3756-3759

a=9.1240(3)Å b=12.5563(5)Å c=15.4232(5)Å

α=108.753(3)° β=100.834(3)° γ=98.211(3)°

C₅₆H₃₄F₂N₂O_4,H₂O

Colquhoun, Howard M.Zhu, Zhixue Cardin, Christine J.White, Andrew J. P.Drew, Michael G. B.Gan, Yu

Organic letters (2010) 12, 17 3756-3759

a=37.353(6)Å b=15.704(2)Å c=7.5165(11)Å

α=90.00° β=90.00° γ=90.00°

C₇₈H₄₅FN₃O₁₂S₂

Colquhoun, Howard M.Zhu, Zhixue Cardin, Christine J.White, Andrew J. P.Drew, Michael G. B.Gan, Yu

Organic letters (2010) 12, 17 3756-3759

a=12.0725(5)Å b=22.6806(10)Å c=32.2434(14)Å

α=84.168(4)° β=85.204(4)° γ=74.958(4)°

C₄₈H₅₄F₂N₆O₈

Colquhoun, Howard M.Zhu, Zhixue Cardin, Christine J.White, Andrew J. P.Drew, Michael G. B.Gan, Yu

Organic letters (2010) 12, 17 3756-3759

a=8.572(3)Å b=9.6617(15)Å c=13.723(2)Å

α=93.667(13)° β=92.869(18)° γ=96.670(17)°

C₁₈H₂₄O₅

Patel, Paresma R.Boger, Dale L.

Organic letters (2010) 12, 15 3540-3543

a=7.4222(15)Å b=9.2295(18)Å c=13.544(3)Å

α=85.00(3)° β=74.87(3)° γ=84.77(3)°

C₁₆H₁₉NO₃

Patel, Paresma R.Boger, Dale L.

Organic letters (2010) 12, 15 3540-3543

a=19.271(4)Å b=9.7160(19)Å c=17.520(4)Å

α=90.00° β=117.04(3)° γ=90.00°

C₃₀H₂₁N₃O₆

Jones, Ian M.Hamilton, Andrew D.

Organic letters (2010) 12, 16 3651-3653

a=8.2637(11)Å b=12.0452(17)Å c=13.7503(19)Å

α=76.768(3)° β=80.817(3)° γ=69.691(3)°

C₂₂H₂₈Br₂O₂

Shenvi, Ryan A.Corey, E. J.

Organic letters (2010) 12, 15 3548-3551

a=9.211(2)Å b=10.794(2)Å c=11.994(4)Å

α=106.031(5)° β=96.445(5)° γ=112.428(3)°

C₅₈H₆₈Br₄O₇

Shenvi, Ryan A.Corey, E. J.

Organic letters (2010) 12, 15 3548-3551

a=19.335(2)Å b=7.4272(10)Å c=20.267(3)Å

α=90.00° β=104.272(2)° γ=90.00°

C₂₄H₃₀N₂O₅

Kulyk, Svitlana Dougherty, Jr, William G Kassel, W. Scott Fleming, Steven A.Sieburth, Scott McN

Organic letters (2010) 12, 15 3296-3299

a=13.6877(10)Å b=9.8076(7)Å c=15.7743(11)Å

α=90.00° β=90.763(3)° γ=90.00°

10026a

C₂₃H₂₅NO₄S

Li, Hongyan Hsung, Richard P.DeKorver, Kyle A.Wei, Yonggang

Organic letters (2010) 12, 17 3780-3783

a=8.2740(9)Å b=10.2749(11)Å c=23.741(3)Å

α=90.00° β=90.00° γ=90.00°

C₃₃H₃₃Cl₃N₂O₆S₁

Li, Meiling Dixon, Darren J.

Organic letters (2010) 12, 17 3784-3787

a=5.76190(10)Å b=19.3032(2)Å c=29.1369(5)Å

α=90° β=90° γ=90°

C₁₇H₁₉NO₆

Xu, Silong Zou, Wen Wu, Guiping Song, Haibin He, Zhengjie

Organic letters (2010) 12, 15 3556-3559

a=8.8667(18)Å b=9.0480(18)Å c=11.101(2)Å

α=105.71(3)° β=98.61(3)° γ=96.29(3)°

C₁₈H₂₂O₄

Xu, Silong Zou, Wen Wu, Guiping Song, Haibin He, Zhengjie

Organic letters (2010) 12, 15 3556-3559

a=14.985(3)Å b=7.5030(14)Å c=15.386(3)Å

α=90.00° β=108.888(11)° γ=90.00°

Boc-(Leu-Leu-Ac5c[OMe])2-OMe

C₄₄H₇₈N₆O₁₁

Nagano, Masanobu Doi, Mitsunobu Kurihara, Masaaki Suemune, Hiroshi Tanaka, Masakazu

Organic letters (2010) 12, 15 3564-3566

a=21.328(3)Å b=21.328(3)Å c=29.108(6)Å

α=90.00° β=90.00° γ=120.00°

Boc-{L-Leu-L-Leu-[(1S,3S)-Ac5c(OM)]}3-OMe

C₆₃H₁₁₁N₉O_15,2(H₂O)

Nagano, Masanobu Doi, Mitsunobu Kurihara, Masaaki Suemune, Hiroshi Tanaka, Masakazu

Organic letters (2010) 12, 15 3564-3566

a=12.247(2)Å b=15.641(3)Å c=77.051(15)Å

α=90.00° β=90.00° γ=90.00°

H2N-{L-Leu-L-Leu-[(S,S)-Ac5c(dOM)]}4-OMe

C₈₁H₁₄₄N₁₂O_21,C₃H₇NO

Nagano, Masanobu Doi, Mitsunobu Kurihara, Masaaki Suemune, Hiroshi Tanaka, Masakazu

Organic letters (2010) 12, 15 3564-3566

a=11.2535(9)Å b=11.6895(9)Å c=19.1693(15)Å

α=86.4600(10)° β=80.7790(10)° γ=87.4280(10)°

C₂₄H₂₄N₂O₆S

Zhu, Zhi-Bin Shi, Min

Organic letters (2010) 12, 20 4462-4465

a=13.5739(16)Å b=15.7377(17)Å c=11.1867(13)Å

α=90.00° β=101.209(2)° γ=90.00°

C₁₁H₁₄N₂O

Wei, Ying Liu, Jing Lin, Shaoxia Ding, Hongqian Liang, Fushun Zhao, Baozhong

Organic Letters (2010) 12, 19 4220-4223

a=8.925(5)Å b=13.408(7)Å c=17.122(9)Å

α=90.00° β=91.162(7)° γ=90.00°