Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1502103 | CIF | C67 H92 B4 N2 O15 | P 21 21 21 | 11.01; 18.968; 33.023 90; 90; 90 | 6896 | Teraoka, Takuro; Hiroto, Satoru; Shinokubo, Hiroshi Iridium-catalyzed direct tetraborylation of perylene bisimides. Organic letters, 2011, 13, 2532-2535 |
| 1502104 | CIF | C25.5 H29.5 N1.5 O3.5 P | P 21 21 21 | 10.7654; 19.089; 23.5235 90; 90; 90 | 4834.1 | Ingle, Gajendrasingh K.; Liang, Yuxue; Mormino, Michael G.; Li, Guilong; Fronczek, Frank R.; Antilla, Jon C. Chiral magnesium BINOL phosphate-catalyzed phosphination of imines: access to enantioenriched α-amino phosphine oxides. Organic letters, 2011, 13, 2054-2057 |
| 1502105 | CIF | C17 H18 N2 O5 | C 1 2/c 1 | 35.653; 6.9183; 14.1033 90; 112.256; 90 | 3219.52 | Donohoe, Timothy J.; Connolly, Matthew J.; Rathi, Akshat H.; Walton, Lesley Intramolecular hydride addition to pyridinium salts: new routes to enantiopure dihydropyridones. Organic letters, 2011, 13, 2074-2077 |
| 1502106 | CIF | C93 H81 O6 | P -1 | 23.457; 23.757; 26.589 89.981; 70.807; 81.113 | 13805 | Venkataramana, Gandikota; Dongare, Prateek; Dawe, Louise N.; Thompson, David W.; Zhao, Yuming; Bodwell, Graham J. 1,8-Pyrenylene-ethynylene macrocycles. Organic letters, 2011, 13, 2240-2243 |
| 1502107 | CIF | C13 H16 O4 | P b c n | 13.5; 15.178; 11.351 90; 90; 90 | 2325.9 | Egan, Ben A.; Paradowski, Michael; Thomas, Lynne H.; Marquez, Rodolfo Regiocontrolled rearrangement of isobenzofurans. Organic letters, 2011, 13, 2086-2089 |
| 1502108 | CIF | C13 H16 O4 | P 21 21 21 | 8.8027; 9.9264; 13.7092 90; 90; 90 | 1197.9 | Egan, Ben A.; Paradowski, Michael; Thomas, Lynne H.; Marquez, Rodolfo Regiocontrolled rearrangement of isobenzofurans. Organic letters, 2011, 13, 2086-2089 |
| 1502109 | CIF | C19 H20 O4 | P 1 21/c 1 | 8.0746; 10.5381; 19.0147 90; 98; 90 | 1602.23 | Egan, Ben A.; Paradowski, Michael; Thomas, Lynne H.; Marquez, Rodolfo Regiocontrolled rearrangement of isobenzofurans. Organic letters, 2011, 13, 2086-2089 |
| 1502110 | CIF | C22 H31 N O5 Si | P 21 21 21 | 10.7398; 8.2057; 25.488 90; 90; 90 | 2246.2 | Egan, Ben A.; Paradowski, Michael; Thomas, Lynne H.; Marquez, Rodolfo Regiocontrolled rearrangement of isobenzofurans. Organic letters, 2011, 13, 2086-2089 |
| 1502111 | CIF | C15 H26 O2 | P 21 21 21 | 12.146; 12.8011; 18.387 90; 90; 90 | 2858.9 | Ushakov, Dmitry B.; Navickas, Vaidotas; Ströbele, Markus; Maichle-Mössmer, Cäcilia; Sasse, Florenz; Maier, Martin E. Total synthesis and biological evaluation of (-)-9-deoxy-englerin A. Organic letters, 2011, 13, 2090-2093 |
| 1502112 | CIF | C12 H20 O2 | P 21 21 21 | 7.5572; 8.5747; 17.595 90; 90; 90 | 1140.2 | Ushakov, Dmitry B.; Navickas, Vaidotas; Ströbele, Markus; Maichle-Mössmer, Cäcilia; Sasse, Florenz; Maier, Martin E. Total synthesis and biological evaluation of (-)-9-deoxy-englerin A. Organic letters, 2011, 13, 2090-2093 |
| 1502113 | CIF | C41 H52 O5 S4 | P 4/n m m :2 | 15.7827; 15.7827; 8.2365 90; 90; 90 | 2051.7 | Morohashi, Naoya; Noji, Shintaro; Nakayama, Hiroko; Kudo, Yasutaka; Tanaka, Shinya; Kabuto, Chizuko; Hattori, Tetsutaro Unique inclusion properties of crystalline powder p-tert-butylthiacalix[4]arene toward alcohols and carboxylic acids. Organic letters, 2011, 13, 3292-3295 |
| 1502114 | CIF | C42 H54 O5 S4 | P 4/n m m :2 | 15.8115; 15.8115; 8.2875 90; 90; 90 | 2071.9 | Morohashi, Naoya; Noji, Shintaro; Nakayama, Hiroko; Kudo, Yasutaka; Tanaka, Shinya; Kabuto, Chizuko; Hattori, Tetsutaro Unique inclusion properties of crystalline powder p-tert-butylthiacalix[4]arene toward alcohols and carboxylic acids. Organic letters, 2011, 13, 3292-3295 |
| 1502115 | CIF | C43 H56 O5 S4 | P 4/n m m :2 | 15.7986; 15.7986; 8.5474 90; 90; 90 | 2133.4 | Morohashi, Naoya; Noji, Shintaro; Nakayama, Hiroko; Kudo, Yasutaka; Tanaka, Shinya; Kabuto, Chizuko; Hattori, Tetsutaro Unique inclusion properties of crystalline powder p-tert-butylthiacalix[4]arene toward alcohols and carboxylic acids. Organic letters, 2011, 13, 3292-3295 |
| 1502116 | CIF | C42 H52 O6 S4 | P 4/n m m :2 | 15.8002; 15.8002; 8.3491 90; 90; 90 | 2084.3 | Morohashi, Naoya; Noji, Shintaro; Nakayama, Hiroko; Kudo, Yasutaka; Tanaka, Shinya; Kabuto, Chizuko; Hattori, Tetsutaro Unique inclusion properties of crystalline powder p-tert-butylthiacalix[4]arene toward alcohols and carboxylic acids. Organic letters, 2011, 13, 3292-3295 |
| 1502117 | CIF | C49 H66 O10 S4 | I 4/m m m | 15.401; 15.401; 21.204 90; 90; 90 | 5029 | Morohashi, Naoya; Noji, Shintaro; Nakayama, Hiroko; Kudo, Yasutaka; Tanaka, Shinya; Kabuto, Chizuko; Hattori, Tetsutaro Unique inclusion properties of crystalline powder p-tert-butylthiacalix[4]arene toward alcohols and carboxylic acids. Organic letters, 2011, 13, 3292-3295 |
| 1502118 | CIF | C22 H25 N O S Si | P 1 21 1 | 11.1147; 6.7725; 14.8896 90; 108.29; 90 | 1064.18 | Vyas, Devendra J.; Fröhlich, Roland; Oestreich, Martin Activation of the Si-B linkage: copper-catalyzed addition of nucleophilic silicon to imines. Organic letters, 2011, 13, 2094-2097 |
| 1502119 | CIF | C16 H17 N3 | P b c a | 13.2943; 7.4099; 27.6216 90; 90; 90 | 2721 | Kumar, Rapolu Kiran; Ali, Md Ashif; Punniyamurthy, Tharmalingam Pd-catalyzed C-H activation/C-N bond formation: a new route to 1-aryl-1H-benzotriazoles. Organic letters, 2011, 13, 2102-2105 |
| 1502120 | CIF | C30 H26 O2 Si2 | P 1 21/c 1 | 6.366; 22.34; 9.457 90; 96.44; 90 | 1336.5 | Rose, Bradley D.; Chase, Daniel T.; Weber, Christopher D.; Zakharov, Lev N.; Lonergan, Mark C.; Haley, Michael M. Synthesis, crystal structures, and photophysical properties of electron-accepting diethynylindenofluorenediones. Organic letters, 2011, 13, 2106-2109 |
| 1502121 | CIF | C42 H50 O2 Si2 | P -1 | 7.419; 7.535; 16.904 87.087; 82.826; 79.38 | 921.1 | Rose, Bradley D.; Chase, Daniel T.; Weber, Christopher D.; Zakharov, Lev N.; Lonergan, Mark C.; Haley, Michael M. Synthesis, crystal structures, and photophysical properties of electron-accepting diethynylindenofluorenediones. Organic letters, 2011, 13, 2106-2109 |
| 1502122 | CIF | C60 H38 O2 Si2 | P -1 | 9.047; 10.1467; 13.3148 79.768; 78.065; 69.549 | 1113 | Rose, Bradley D.; Chase, Daniel T.; Weber, Christopher D.; Zakharov, Lev N.; Lonergan, Mark C.; Haley, Michael M. Synthesis, crystal structures, and photophysical properties of electron-accepting diethynylindenofluorenediones. Organic letters, 2011, 13, 2106-2109 |
| 1502123 | CIF | C33 H26 Cl2 N O6 P | P -1 | 10.5159; 12.1257; 12.5652 86.115; 75.775; 74.108 | 1493.73 | Deng, Jie-Cheng; Chuang, Shih-Ching Three-component and nonclassical reaction of phosphines with enynes and aldehydes: formation of γ-lactones featuring α-phosphorus ylides. Organic letters, 2011, 13, 2248-2251 |
| 1502124 | CIF | C23 H17 N3 | P 1 21/c 1 | 14.2399; 8.1577; 15.2401 90; 94.049; 90 | 1765.9 | Dutta, Saikat; Bučar, Dejan-Krešimir; MacGillivray, Leonard R. Resorcinol-templated synthesis of a cofacial terpyridine in crystalline π-stacked columns. Organic letters, 2011, 13, 2260-2262 |
| 1502125 | CIF | C29 H22 I N3 O2 | P -1 | 7.531; 13.2092; 25.014 91.805; 91.456; 95.53 | 2474.5 | Dutta, Saikat; Bučar, Dejan-Krešimir; MacGillivray, Leonard R. Resorcinol-templated synthesis of a cofacial terpyridine in crystalline π-stacked columns. Organic letters, 2011, 13, 2260-2262 |
| 1502126 | CIF | C58 H44 I2 N6 O4 | P 1 21/n 1 | 17.8364; 13.0324; 21.83 90; 99.141; 90 | 5010 | Dutta, Saikat; Bučar, Dejan-Krešimir; MacGillivray, Leonard R. Resorcinol-templated synthesis of a cofacial terpyridine in crystalline π-stacked columns. Organic letters, 2011, 13, 2260-2262 |
| 1502127 | CIF | C29 H21 I2 N3 O2 | P 1 21/c 1 | 11.1705; 25.888; 9.2658 90; 95.121; 90 | 2668.8 | Dutta, Saikat; Bučar, Dejan-Krešimir; MacGillivray, Leonard R. Resorcinol-templated synthesis of a cofacial terpyridine in crystalline π-stacked columns. Organic letters, 2011, 13, 2260-2262 |
| 1502128 | CIF | C29 H24 N3 O2.5 | P 1 21/c 1 | 25.06; 8.2435; 23.26 90; 91.409; 90 | 4803.6 | Dutta, Saikat; Bučar, Dejan-Krešimir; MacGillivray, Leonard R. Resorcinol-templated synthesis of a cofacial terpyridine in crystalline π-stacked columns. Organic letters, 2011, 13, 2260-2262 |
| 1502129 | CIF | C61 H69 Cl4 N11 O5 Zn2 | P -1 | 13.4654; 14.177; 18.8934 72.059; 73.5; 64.793 | 3055.3 | Dutta, Saikat; Bučar, Dejan-Krešimir; MacGillivray, Leonard R. Resorcinol-templated synthesis of a cofacial terpyridine in crystalline π-stacked columns. Organic letters, 2011, 13, 2260-2262 |
| 1502130 | CIF | C92 H68 Cu4 N20 O28 | C 1 2/c 1 | 30.119; 20.405; 16.284 90; 100.895; 90 | 9827 | Dutta, Saikat; Bučar, Dejan-Krešimir; MacGillivray, Leonard R. Resorcinol-templated synthesis of a cofacial terpyridine in crystalline π-stacked columns. Organic letters, 2011, 13, 2260-2262 |
| 1502131 | CIF | C21 H23 Cl Ir N O | P -1 | 8.4451; 10.5706; 11.3837 73.5179; 74.6237; 73.8917 | 916.83 | Fujita, Ken-ichi; Yoshida, Tetsuya; Imori, Yoichiro; Yamaguchi, Ryohei Dehydrogenative oxidation of primary and secondary alcohols catalyzed by a Cp*Ir complex having a functional C,N-chelate ligand. Organic letters, 2011, 13, 2278-2281 |
| 1502132 | CIF | C13 H14 N2 O4 | P -1 | 5.0939; 11.4983; 12.4598 113.914; 99.967; 95.827 | 645.01 | Singh, Anand; Roth, Gregory P. A [3+2] dipolar cycloaddition route to 3-hydroxy-3-alkyl oxindoles: an approach to pyrrolidinoindoline alkaloids. Organic letters, 2011, 13, 2118-2121 |
| 1502133 | CIF | C32 H29 Br N2 O7 | P 21 21 21 | 10.774; 14.2273; 19.8345 90; 90; 90 | 3040.3 | Duan, Shu-Wen; An, Jing; Chen, Jia-Rong; Xiao, Wen-Jing Facile synthesis of enantioenriched Cγ-tetrasubstituted α-amino acid derivatives via an asymmetric nucleophilic addition/protonation cascade. Organic letters, 2011, 13, 2290-2293 |
| 1502134 | CIF | C28 H19 Au Cl P | P 1 21/c 1 | 9.705; 23.07; 10.283 90; 113.342; 90 | 2113.9 | Hatakeyama, Takuji; Hashimoto, Sigma; Nakamura, Masaharu Tandem phospha-Friedel-Crafts reaction toward curved π-conjugated frameworks with a phosphorus ring junction. Organic letters, 2011, 13, 2130-2133 |
| 1502135 | CIF | C26 H15 P S | P 1 21/n 1 | 8.854; 17.03; 12.111 90; 96.124; 90 | 1815.7 | Hatakeyama, Takuji; Hashimoto, Sigma; Nakamura, Masaharu Tandem phospha-Friedel-Crafts reaction toward curved π-conjugated frameworks with a phosphorus ring junction. Organic letters, 2011, 13, 2130-2133 |
| 1502136 | CIF | C28 H19 P S | P n a 21 | 9.4741; 12.37; 17.179 90; 90; 90 | 2013.3 | Hatakeyama, Takuji; Hashimoto, Sigma; Nakamura, Masaharu Tandem phospha-Friedel-Crafts reaction toward curved π-conjugated frameworks with a phosphorus ring junction. Organic letters, 2011, 13, 2130-2133 |
| 1502137 | CIF | C30 H19 P S | P -1 | 8.1709; 11.9296; 20.3704 90.222; 93.98; 91.528 | 1980.1 | Hatakeyama, Takuji; Hashimoto, Sigma; Nakamura, Masaharu Tandem phospha-Friedel-Crafts reaction toward curved π-conjugated frameworks with a phosphorus ring junction. Organic letters, 2011, 13, 2130-2133 |
| 1502138 | CIF | C28 H19 O P | P 1 21/n 1 | 7.2044; 20.622; 13.225 90; 102.745; 90 | 1916.4 | Hatakeyama, Takuji; Hashimoto, Sigma; Nakamura, Masaharu Tandem phospha-Friedel-Crafts reaction toward curved π-conjugated frameworks with a phosphorus ring junction. Organic letters, 2011, 13, 2130-2133 |
| 1502139 | CIF | C28 H19 P | P 1 21/a 1 | 11.8709; 18.0107; 9.9332 90; 117.349; 90 | 1886.4 | Hatakeyama, Takuji; Hashimoto, Sigma; Nakamura, Masaharu Tandem phospha-Friedel-Crafts reaction toward curved π-conjugated frameworks with a phosphorus ring junction. Organic letters, 2011, 13, 2130-2133 |
| 1502140 | CIF | C23 H22 O2 | P -1 | 8.8401; 13.1944; 15.906 95.193; 98.155; 96.746 | 1812.9 | Cheng, Kevin; Carroll, Patrick J.; Walsh, Patrick J. Diasteroselective preparation of cyclopropanols using methylene bis(iodozinc). Organic letters, 2011, 13, 2346-2349 |
| 1502141 | CIF | C28 H26 Br N O2 | C 1 2 1 | 23.306; 5.8518; 17.515 90; 91.215; 90 | 2388.2 | Cao, Ziping; Liu, Yilin; Liu, Zhaoqun; Feng, Xiangqing; Zhuang, Minyang; Du, Haifeng Pd-catalyzed asymmetric allylic alkylation of indoles and pyrroles by chiral alkene-phosphine ligands. Organic letters, 2011, 13, 2164-2167 |
| 1502142 | CIF | C21 H30 Br N2 Rh | P 1 21/n 1 | 9.7809; 15.4141; 13.4965 90; 97.714; 90 | 2016.37 | Kim, Hyun Jin; Kim, Min; Chang, Sukbok Rhodium(NHC)-catalyzed O-arylation of aryl bromides. Organic letters, 2011, 13, 2368-2371 |
| 1502143 | CIF | C25 H27 N O3 | P 21 21 21 | 9.6818; 14.3637; 15.1077 90; 90; 90 | 2100.97 | Bentley, Scott A.; Davies, Stephen G.; Lee, James A.; Roberts, Paul M.; Thomson, James E. Conjugate addition of lithium N-phenyl-N-(α-methylbenzyl)amide: application to the asymmetric synthesis of (R)-(-)-angustureine. Organic letters, 2011, 13, 2544-2547 |
| 1502144 | CIF | C22 H17 N O | C 1 c 1 | 5.997; 19.04; 14.366 90; 90.985; 90 | 1640 | Ren, Hui; Luo, Yong; Ye, Shengqing; Wu, Jie Silver triflate catalyzed reaction of 2-alkynylbenzaldoxime with aryne. Organic letters, 2011, 13, 2552-2555 |
| 1502145 | CIF | C21 H22 O S3 | P -1 | 8.42633; 25.5835; 27.259 80.7938; 85.1722; 83.6729 | 5752.06 | Nielsen, Christian B.; Fraser, Jamie M.; Schroeder, Bob C.; Du, Junping; White, Andrew J. P.; Zhang, Weimin; McCulloch, Iain Benzotrithiophene‒a planar, electron-rich building block for organic semiconductors. Organic letters, 2011, 13, 2414-2417 |
| 1502146 | CIF | C24 H25 Br N2 O8 | P 21 21 21 | 8.066; 8.898; 34.816 90; 90; 90 | 2499 | Cheng, Mou-Nuo; Wang, Hao; Gong, Liu-Zhu Asymmetic organocatalytic 1,3-dipolar cycloaddition of azomethine ylide to methyl 2-(2-nitrophenyl)acrylate for the synthesis of diastereoisomers of spirotryprostatin A. Organic letters, 2011, 13, 2418-2421 |
| 1502147 | CIF | C40 H17 F10 N3 | P 1 21/n 1 | 13.6059; 12.3268; 20.1794 90; 105.299; 90 | 3264.5 | Anju, K. S.; Ramakrishnan, S.; Srinivasan, A. meso-Aryl triphyrin(2.1.1). Organic letters, 2011, 13, 2498-2501 |
| 1502148 | CIF | C18 H15 N O | P 1 21/c 1 | 10.424; 16.83; 7.934 90; 94.025; 90 | 1388 | Qian, Bo; Xie, Pan; Xie, Yinjun; Huang, Hanmin Iron-catalyzed direct alkenylation of 2-substituted azaarenes with N-sulfonyl aldimines via C-H bond activation. Organic letters, 2011, 13, 2580-2583 |
| 1502149 | CIF | C15 H21 Br N2 O2 S | P n a 21 | 14.897; 7.9148; 14.525 90; 90; 90 | 1712.6 | Zhou, Ling; Zhou, Jing; Tan, Chong Kiat; Chen, Jie; Yeung, Ying-Yeung N-bromosuccinimide initiated one-pot synthesis of imidazoline. Organic letters, 2011, 13, 2448-2451 |
| 1502150 | CIF | C22 H19 N3 O4 S | P 1 21/c 1 | 9.2012; 10.9019; 20.4358 90; 101.081; 90 | 2011.71 | Zhou, Ling; Zhou, Jing; Tan, Chong Kiat; Chen, Jie; Yeung, Ying-Yeung N-bromosuccinimide initiated one-pot synthesis of imidazoline. Organic letters, 2011, 13, 2448-2451 |
| 1502151 | CIF | C19 H26 N2 O2 S | P 1 21/c 1 | 14.8341; 8.296; 15.3758 90; 109.739; 90 | 1781 | Zhou, Ling; Zhou, Jing; Tan, Chong Kiat; Chen, Jie; Yeung, Ying-Yeung N-bromosuccinimide initiated one-pot synthesis of imidazoline. Organic letters, 2011, 13, 2448-2451 |
| 1502152 | CIF | C14 H19 N3 O2 S | P -1 | 8.1392; 9.2199; 10.1987 101.018; 99.441; 93.082 | 738.19 | Meza-Aviña, Maria Elena; Patel, Mudita Kishor; Lee, Cylivia B.; Dietz, Thomas J.; Croatt, Mitchell P. Selective formation of 1,5-substituted sulfonyl triazoles using acetylides and sulfonyl azides. Organic letters, 2011, 13, 2984-2987 |
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