Crystallography Open Database
Search results
Result: there are 528227 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format
We are unable to provide that many records as a single archive.
You can instead download the entire COD archive as a single .zip, .tgz or .txz archive.
Displaying all data in COD
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1502603 | CIF | C30 H33 N O5 S | P 1 21/c 1 | 14.21; 10.072; 19.29 90; 90.054; 90 | 2761 | Zheng, Huaiji; Huo, Xing; Zhao, Changgui; Jing, Peng; Yang, Juan; Fang, Bowen; She, Xuegong Au-catalyzed piperidine synthesis via tandem acyloxy migration/intramolecular [3 + 2] cycloaddition of enynyl esters. Organic letters, 2011, 13, 6448-6451 |
| 1502604 | CIF | C22 H23 N O4 S | P c a 21 | 15.819; 11.095; 11.877 90; 90; 90 | 2085 | Zheng, Huaiji; Huo, Xing; Zhao, Changgui; Jing, Peng; Yang, Juan; Fang, Bowen; She, Xuegong Au-catalyzed piperidine synthesis via tandem acyloxy migration/intramolecular [3 + 2] cycloaddition of enynyl esters. Organic letters, 2011, 13, 6448-6451 |
| 1502605 | CIF | C23 H26 N2 O7 | P 1 21/c 1 | 16.582; 9.8096; 14.674 90; 107.269; 90 | 2279.3 | McGarraugh, Patrick G.; Brenner-Moyer, Stacey E An organocascade kinetic resolution. Organic letters, 2011, 13, 6460-6463 |
| 1502606 | CIF | C13 H11 B F2 N2 O | P -1 | 7.141; 7.661; 22.911 99.035; 92.721; 94.612 | 1231.5 | Kubota, Yasuhiro; Hara, Hiroshi; Tanaka, Syunki; Funabiki, Kazumasa; Matsui, Masaki Synthesis and fluorescence properties of novel pyrazine-boron complexes bearing a β-iminoketone ligand. Organic letters, 2011, 13, 6544-6547 |
| 1502607 | CIF | C25 H21 B N2 O | P 1 21/c 1 | 8.812; 11.747; 19.548 90; 90.68; 90 | 2023.4 | Kubota, Yasuhiro; Hara, Hiroshi; Tanaka, Syunki; Funabiki, Kazumasa; Matsui, Masaki Synthesis and fluorescence properties of novel pyrazine-boron complexes bearing a β-iminoketone ligand. Organic letters, 2011, 13, 6544-6547 |
| 1502608 | CIF | C27 H26 B N3 O | P 1 21/n 1 | 12.294; 8.786; 21.378 90; 98.416; 90 | 2284.3 | Kubota, Yasuhiro; Hara, Hiroshi; Tanaka, Syunki; Funabiki, Kazumasa; Matsui, Masaki Synthesis and fluorescence properties of novel pyrazine-boron complexes bearing a β-iminoketone ligand. Organic letters, 2011, 13, 6544-6547 |
| 1502609 | CIF | C15 H16 B F2 N3 O | P 1 21/a 1 | 7.632; 11.523; 16.749 90; 98.856; 90 | 1455.4 | Kubota, Yasuhiro; Hara, Hiroshi; Tanaka, Syunki; Funabiki, Kazumasa; Matsui, Masaki Synthesis and fluorescence properties of novel pyrazine-boron complexes bearing a β-iminoketone ligand. Organic letters, 2011, 13, 6544-6547 |
| 1502610 | CIF | C28 H38 O5 Si2 | P 1 21 1 | 13.4488; 12.1633; 18.4592 90; 108.832; 90 | 2857.9 | Adachi, Masaatsu; Yamada, Hitomi; Isobe, Minoru; Nishikawa, Toshio Total synthesis of polygalolide A. Organic letters, 2011, 13, 6532-6535 |
| 1502611 | CIF | C14 H14 O3 | P -1 | 8.107; 8.585; 9.637 112.308; 107.086; 97.024 | 572 | Grillet, Francois; Huang, Chaofeng; Brummond, Kay M. An allenic Pauson-Khand approach to 6,12-guaianolides. Organic letters, 2011, 13, 6304-6307 |
| 1502612 | CIF | C22 H17 Cl4 N3 Pd | P 1 21/n 1 | 8.2973; 29.0172; 9.8779 90; 108.728; 90 | 2252.33 | Zhu, Ming-Kui; Zhao, Jun-Feng; Loh, Teck-Peng Palladium-catalyzed C-C bond formation of arylhydrazines with olefins via carbon-nitrogen bond cleavage. Organic letters, 2011, 13, 6308-6311 |
| 1502613 | CIF | C18 H20 N2 O2 | P b c a | 7.8221; 14.5983; 27.4837 90; 90; 90 | 3138.3 | Yagishita, Fumitoshi; Sakamoto, Masami; Mino, Takashi; Fujita, Tsutomu Asymmetric intramolecular cyclobutane formation via photochemical reaction of N,N-diallyl-2-quinolone-3-carboxamide using a chiral crystalline environment. Organic letters, 2011, 13, 6168-6171 |
| 1502614 | CIF | C19 H22 N2 O2 | P 1 21/c 1 | 16.127; 9.1351; 12.0699 90; 102.693; 90 | 1734.7 | Yagishita, Fumitoshi; Sakamoto, Masami; Mino, Takashi; Fujita, Tsutomu Asymmetric intramolecular cyclobutane formation via photochemical reaction of N,N-diallyl-2-quinolone-3-carboxamide using a chiral crystalline environment. Organic letters, 2011, 13, 6168-6171 |
| 1502615 | CIF | C20 H24 N2 O2 | P 1 21 1 | 8.8113; 7.6399; 13.258 90; 93.732; 90 | 890.6 | Yagishita, Fumitoshi; Sakamoto, Masami; Mino, Takashi; Fujita, Tsutomu Asymmetric intramolecular cyclobutane formation via photochemical reaction of N,N-diallyl-2-quinolone-3-carboxamide using a chiral crystalline environment. Organic letters, 2011, 13, 6168-6171 |
| 1502616 | CIF | C20 H26 N2 O2 | P 1 21/c 1 | 15.726; 9.432; 12.59 90; 103.66; 90 | 1814.6 | Yagishita, Fumitoshi; Sakamoto, Masami; Mino, Takashi; Fujita, Tsutomu Asymmetric intramolecular cyclobutane formation via photochemical reaction of N,N-diallyl-2-quinolone-3-carboxamide using a chiral crystalline environment. Organic letters, 2011, 13, 6168-6171 |
| 1502617 | CIF | C31 H28 Cl N7 O | P 1 21/c 1 | 15.473; 18.679; 18.972 90; 95.737; 90 | 5455.8 | Wang, Zu-Li; Zhao, Liang; Wang, Mei-Xiang Regiospecific functionalization of azacalixaromatics through copper-mediated aryl C-H activation and C-O bond formation. Organic letters, 2011, 13, 6560-6563 |
| 1502618 | CIF | C17 H23 N O3 S | P 21 21 21 | 9.6319; 10.4594; 16.7964 90; 90; 90 | 1692.13 | Fustero, Santos; Rodríguez, Elsa; Herrera, Lidia; Asensio, Amparo; Maestro, Miguel A.; Barrio, Pablo Intramolecular Michael reaction of tert-butylsulfinyl ketimines: asymmetric synthesis of 3-substituted indanones. Organic letters, 2011, 13, 6564-6567 |
| 1502619 | CIF | C15 H22 N O3 P | P 1 21 1 | 9.4722; 10.0791; 16.3227 90; 92.756; 90 | 1556.55 | Adams, Harry; Collins, Rebecca C.; Jones, Simon; Warner, Christopher J. A. Enantioselective preparation of P-chiral phosphine oxides. Organic letters, 2011, 13, 6576-6579 |
| 1502620 | CIF | C14 H17 N O3 | P 21 21 21 | 6.3728; 12.4132; 15.5812 90; 90; 90 | 1232.58 | Lim, Hwan Jung; RajanBabu, T. V. Ethylene in organic synthesis: a new route to anticholenergic pyrrolidinoindolines, and other molecules with all carbon-quaternary centers via asymmetric hydrovinylation. Organic letters, 2011, 13, 6596-6599 |
| 1502621 | CIF | C13 H15 N O | P 1 21/n 1 | 8.5745; 14.1089; 8.8408 90; 94.154; 90 | 1066.72 | Lim, Hwan Jung; RajanBabu, T. V. Ethylene in organic synthesis: a new route to anticholenergic pyrrolidinoindolines, and other molecules with all carbon-quaternary centers via asymmetric hydrovinylation. Organic letters, 2011, 13, 6596-6599 |
| 1502622 | CIF | C18 H25 Cl N O2.5 | P 21 21 21 | 6.9608; 15.583; 31.3056 90; 90; 90 | 3395.7 | Shevchenko, Anna; Belle, David Din; Tiittanen, Saara; Karjalainen, Arto; Tolvanen, Arto; Tanninen, Veli Pekka; Haarala, Jorma; Mäkelä, Mikko; Yliruusi, Jouko; Miroshnyk, Inna Coupling Polymorphism/Solvatomorphism and Physical Stability Evaluation with Early Salt Synthesis Optimization of an Investigational Drug Organic Process Research & Development, 2011, 15, 666 |
| 1502623 | CIF | C74 H84 Cl2 N6 P2 Ru | C 1 2 1 | 24.264; 24.798; 26.166 90; 104.12; 90 | 15268 | Goto, Mitsutaka; Konishi, Takahiro; Kawaguchi, Shinji; Yamada, Masatoshi; Nagata, Toshiaki; Yamano, Mitsuhisa Process Research on the Asymmetric Hydrogenation of a Benzophenone for Developing the Manufacturing Process of the Squalene Synthase Inhibitor TAK-475 Organic Process Research & Development, 2011, 15, 1178 |
| 1502624 | CIF | C48 H49 Fe Lu N2 O | P c c a | 20.6899; 23.815; 16.4542 90; 90; 90 | 8107.5 | Diaconescu, Paula L. Reactions of aromatic N-heterocycles with d0fn-metal alkyl complexes supported by chelating diamide ligands. Accounts of chemical research, 2010, 43, 1352-1363 |
| 1502625 | CIF | C23.6 H23 Br0.2 F2.4 N7 O8.6 Re | P 21 21 21 | 8.00672; 15.303; 23.6473 90; 90; 90 | 2897.43 | Struthers, Harriet; Viertl, David; Kosinski, Marek; Spingler, Bernhard; Buchegger, Franz; Schibli, Roger Charge dependent substrate activity of C3' and N3 functionalized, organometallic technetium and rhenium-labeled thymidine derivatives toward human thymidine kinase 1. Bioconjugate chemistry, 2010, 21, 622-634 |
| 1502626 | CIF | C17 H16 Br N O3 S | P 1 21/n 1 | 7.9826; 15.1896; 14.0058 90; 106.311; 90 | 1629.89 | Yao, Chang-Sheng; Wang, Cui-Hua; Jiang, Bei; Tu, Shu-Jiang One-pot combinatorial synthesis of 4-aryl-1H-thiopyrano[3,4-b]pyridine-5-one derivatives. Journal of combinatorial chemistry, 2010, 12, 472-475 |
| 1502627 | CIF | C27 H26 Cl N O2 S | P 1 21/n 1 | 14.7445; 11.168; 15.5403 90; 111.725; 90 | 2377.21 | Yao, Chang-Sheng; Wang, Cui-Hua; Jiang, Bei; Tu, Shu-Jiang One-pot combinatorial synthesis of 4-aryl-1H-thiopyrano[3,4-b]pyridine-5-one derivatives. Journal of combinatorial chemistry, 2010, 12, 472-475 |
| 1502628 | CIF | C24 H27 Cl2 N3 O S | C 1 2/c 1 | 22.27; 11.0361; 19.418 90; 97.983; 90 | 4726.2 | Han, Minsoo; Nam, Kee Dal; Shin, Dongyun; Jeong, Nakcheol; Hahn, Hoh-Gyu Exploration of novel 2-alkylimino-1,3-thiazolines: T-type calcium channel inhibitory activity. Journal of combinatorial chemistry, 2010, 12, 518-530 |
| 1502629 | CIF | C30 H34 Cl N3 O2 S | C 1 2/c 1 | 38.497; 12.466; 11.636 90; 99.309; 90 | 5511 | Han, Minsoo; Nam, Kee Dal; Shin, Dongyun; Jeong, Nakcheol; Hahn, Hoh-Gyu Exploration of novel 2-alkylimino-1,3-thiazolines: T-type calcium channel inhibitory activity. Journal of combinatorial chemistry, 2010, 12, 518-530 |
| 1502630 | CIF | C17 H17 F O3 | P 1 21/c 1 | 9.6423; 20.332; 7.4807 90; 97.331; 90 | 1454.6 | Ramachary, Dhevalapally B.; Ramakumar, Kinthada; Bharanishashank, Adluri; Narayana, Vidadala V. Sequential one-pot combination of multireactions through multicatalysis: a general approach to rapid assembly of functionalized push-pull olefins, phenols, and 2-methyl-2H-chromenes. Journal of combinatorial chemistry, 2010, 12, 855-876 |
| 1502631 | CIF | C19 H19 N O5 | P -1 | 8.025; 8.415; 14.351 87.633; 83.514; 61.76 | 848.2 | Ramachary, Dhevalapally B.; Ramakumar, Kinthada; Bharanishashank, Adluri; Narayana, Vidadala V. Sequential one-pot combination of multireactions through multicatalysis: a general approach to rapid assembly of functionalized push-pull olefins, phenols, and 2-methyl-2H-chromenes. Journal of combinatorial chemistry, 2010, 12, 855-876 |
| 1502632 | CIF | C19 H14 N2 O2 | P 1 21/c 1 | 17.3823; 5.3652; 16.7899 90; 109.752; 90 | 1473.7 | Li, Dewen; Duan, Shudong; Hu, Youhong Three-component one-pot approach to synthesize benzopyrano[4,3-d]pyrimidines. Journal of combinatorial chemistry, 2010, 12, 895-899 |
| 1502633 | CIF | C25 H20 N4 S2 | P 1 21/n 1 | 11.0619; 11.2598; 17.5329 90; 93.662; 90 | 2179.3 | Han, Zheng-Guo; Miao, Chun-Bao; Shi, Feng; Ma, Ning; Zhang, Ge; Tu, Shu-Jiang Diversity Synthesis of N-Substituted 2-Amino-1,6-naphthyridine Derivatives under Microwave Irradiation Journal of Combinatorial Chemistry, 2010, 12, 16 |
| 1502634 | CIF | C22 H35 N3 O2.5 S0.5 | C 1 2/c 1 | 27.1869; 10.2149; 34.7688 90; 106.095; 90 | 9277.2 | Shaabani, Ahmad; Maleki, Ali; Hajishaabanha, Fatemeh; Mofakham, Hamid; Seyyedhamzeh, Mozhdeh; Mahyari, Mojtaba; Ng, Seik Weng Novel Syntheses of Tetrahydrobenzodiazepines and Dihydropyrazines via Isocyanide-Based Multicomponent Reactions of Diamines Journal of Combinatorial Chemistry, 2010, 12, 186 |
| 1502635 | CIF | C18 H25 N3 O2 | P 1 21/n 1 | 5.7118; 25.8049; 11.8905 90; 94.801; 90 | 1746.42 | Shaabani, Ahmad; Maleki, Ali; Hajishaabanha, Fatemeh; Mofakham, Hamid; Seyyedhamzeh, Mozhdeh; Mahyari, Mojtaba; Ng, Seik Weng Novel Syntheses of Tetrahydrobenzodiazepines and Dihydropyrazines via Isocyanide-Based Multicomponent Reactions of Diamines Journal of Combinatorial Chemistry, 2010, 12, 186 |
| 1502636 | CIF | C23 H21 N O3 | P -1 | 9.2085; 9.6607; 11.2222 77.053; 80.455; 71.635 | 918.49 | Lin, Chi-Hui; Chen, Jhih-Rong; Yang, Ding-Yah Syntheses of Quaternary Carbon-Containing Oxazatricycle and Spiropyran Libraries via Multicomponent Reactions and Their Molecular Switching Properties Journal of Combinatorial Chemistry, 2010, 12, 119 |
| 1502637 | CIF | C31 H29 N O5 | P -1 | 9.6289; 12.161; 13.927 75.761; 89.878; 70.641 | 1485.7 | Lin, Chi-Hui; Chen, Jhih-Rong; Yang, Ding-Yah Syntheses of Quaternary Carbon-Containing Oxazatricycle and Spiropyran Libraries via Multicomponent Reactions and Their Molecular Switching Properties Journal of Combinatorial Chemistry, 2010, 12, 119 |
| 1502638 | CIF Paper | C25 H15 Br N4 | P b c a | 14.7393; 10.7465; 25.4251 90; 90; 90 | 4027.23 | Thirumurugan, Prakasam; Nandakumar, A.; Muralidharan, D.; Perumal, Paramasivan T. Simple and Convenient Approach to the Kr€ohnke Pyridine Type Synthesis of Functionalized Indol-3-yl Pyridine Derivatives Using 3-Cyanoacetyl Indole Journal of Combinatorial Chemistry, 2010, 12, 161 |
| 1502639 | CIF Paper | C25 H16 Cl2 N4 | P -1 | 8.0158; 10.0261; 14.3653 72.26; 79.42; 78.224 | 1067.3 | Thirumurugan, Prakasam; Nandakumar, A.; Muralidharan, D.; Perumal, Paramasivan T. Simple and Convenient Approach to the Kr€ohnke Pyridine Type Synthesis of Functionalized Indol-3-yl Pyridine Derivatives Using 3-Cyanoacetyl Indole Journal of Combinatorial Chemistry, 2010, 12, 161 |
| 1502640 | CIF Paper | C25 H14 Cl2 N4 | P 1 21/c 1 | 10.0307; 22.446; 17.932 90; 90.991; 90 | 4036.8 | Thirumurugan, Prakasam; Nandakumar, A.; Muralidharan, D.; Perumal, Paramasivan T. Simple and Convenient Approach to the Kr€ohnke Pyridine Type Synthesis of Functionalized Indol-3-yl Pyridine Derivatives Using 3-Cyanoacetyl Indole Journal of Combinatorial Chemistry, 2010, 12, 161 |
| 1502641 | CIF | C21 H18 Cl N O | P -1 | 9.2367; 9.6213; 10.4565 103.872; 114.049; 92.266 | 813.92 | Wang, Xiang-Shan; Zhou, Jie; Yin, Ming-Yue; Yang, Ke; Tu, Shu-Jiang Efficient and highly selective method for the synthesis of benzo(naphtho)quinoline derivatives catalyzed by iodine. Journal of combinatorial chemistry, 2010, 12, 266-269 |
| 1502642 | CIF | C25 H20 F N O | P -1 | 9.1128; 10.1416; 10.6352 76.379; 81.633; 74.199 | 915.66 | Wang, Xiang-Shan; Zhou, Jie; Yin, Ming-Yue; Yang, Ke; Tu, Shu-Jiang Efficient and highly selective method for the synthesis of benzo(naphtho)quinoline derivatives catalyzed by iodine. Journal of combinatorial chemistry, 2010, 12, 266-269 |
| 1502643 | CIF | C12 H16 N2 O | P 1 21/c 1 | 9.7976; 11.3938; 11.8365 90; 120.442; 90 | 1139.2 | Wang, Xiang-Shan; Yang, Ke; Zhou, Jie; Tu, Shu-Jiang Facile Method for the Combinatorial Synthesis of 2,2-Disubstituted Quinazolin-4(1H)-one Derivatives Catalyzed by Iodine in Ionic Liquids Journal of Combinatorial Chemistry, 2010, 12, 417-421 |
| 1502644 | CIF | C14 H18 N2 O | C 1 2/c 1 | 39.9096; 11.2986; 29.634 90; 131.752; 90 | 9969 | Wang, Xiang-Shan; Yang, Ke; Zhou, Jie; Tu, Shu-Jiang Facile Method for the Combinatorial Synthesis of 2,2-Disubstituted Quinazolin-4(1H)-one Derivatives Catalyzed by Iodine in Ionic Liquids Journal of Combinatorial Chemistry, 2010, 12, 417-421 |
| 1502645 | CIF | C12 H14 N2 O S | P 1 21/n 1 | 6.9285; 14.9028; 10.7454 90; 94.45; 90 | 1106.16 | Wang, Xiang-Shan; Yang, Ke; Zhou, Jie; Tu, Shu-Jiang Facile Method for the Combinatorial Synthesis of 2,2-Disubstituted Quinazolin-4(1H)-one Derivatives Catalyzed by Iodine in Ionic Liquids Journal of Combinatorial Chemistry, 2010, 12, 417-421 |
| 1502646 | CIF | C14 H13 N3 O S | P -1 | 4.906; 9.9103; 14.4818 91.786; 104.35; 110.743 | 632.4 | Soh, Chai Hoon; Lam, Yulin Microwave-assisted synthesis of substituted 2-(benzylthio)imidazo[1,2a]pyrimidin-5-ones. Journal of combinatorial chemistry, 2010, 12, 286-291 |
| 1502647 | CIF | C19 H21 N3 O S | P 1 21/c 1 | 19.8028; 5.2167; 17.3692 90; 108.081; 90 | 1705.72 | Soh, Chai Hoon; Lam, Yulin Microwave-assisted synthesis of substituted 2-(benzylthio)imidazo[1,2a]pyrimidin-5-ones. Journal of combinatorial chemistry, 2010, 12, 286-291 |
| 1502648 | CIF | C22 H19 N3 O2 S | C 1 2/c 1 | 17.4388; 15.7401; 14.454 90; 105.718; 90 | 3819.1 | Soh, Chai Hoon; Lam, Yulin Microwave-assisted synthesis of substituted 2-(benzylthio)imidazo[1,2a]pyrimidin-5-ones. Journal of combinatorial chemistry, 2010, 12, 286-291 |
| 1502649 | CIF | C19 H16 N4 O S | P 1 21/n 1 | 6.9999; 17.428; 13.8297 90; 96.91; 90 | 1674.89 | Soh, Chai Hoon; Lam, Yulin Microwave-assisted synthesis of substituted 2-(benzylthio)imidazo[1,2a]pyrimidin-5-ones. Journal of combinatorial chemistry, 2010, 12, 286-291 |
| 1502650 | CIF | C16 H13 Cl | P -1 | 7.673; 8.574; 9.724 99.406; 93.714; 93.823 | 627.9 | Shi, Min; Shao, Li-Xiong; Lu, Jian-Mei; Wei, Yin; Mizuno, Kazuhiko; Maeda, Hajime Chemistry of vinylidenecyclopropanes. Chemical reviews, 2010, 110, 5883-5913 |
| 1502651 | CIF | C21 H22 | P -1 | 10.3256; 11.1547; 15.7258 108.462; 93.591; 91.936 | 1711.9 | Shi, Min; Shao, Li-Xiong; Lu, Jian-Mei; Wei, Yin; Mizuno, Kazuhiko; Maeda, Hajime Chemistry of vinylidenecyclopropanes. Chemical reviews, 2010, 110, 5883-5913 |
| 1502652 | CIF | C18 H36 Cd N42 O18 | P -1 | 10.3425; 10.3727; 11.9922 110.546; 104.412; 97.464 | 1132.8 | Li, Zhi-Min; Zhang, Jian-Guo; Cui, Yan; Zhang, Tong-Lai; Shu, Yuan-Jie; Sinditskii, Valery P.; Serushkin, Valery V.; Egorshin, Vyacheslav Yu. A Novel Nitrogen-Rich Cadmium Coordination Compound Based on 1,5-Diaminotetrazole: Synthesis, Structure Investigation, and Thermal Properties Journal of Chemical & Engineering Data, 2010, 55, 3109 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!