Crystallography Open Database
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Searching volume of publication is 9
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1548700 | CIF | C14 H19 B10 N | P -1 | 8.9977; 9.8055; 11.2475 87.61; 66.4692; 73.9029 | 871.46 | Chan, Tek Long; Xie, Zuowei Synthesis, structure and aromaticity of carborane-fused carbo- and heterocycles. Chemical science, 2018, 9, 2284-2289 |
| 1548701 | CIF | C36 H67 B10 Li O10 | P -1 | 11.9668; 12.4954; 14.9348 87.27; 75.356; 88.638 | 2158 | Chan, Tek Long; Xie, Zuowei Synthesis, structure and aromaticity of carborane-fused carbo- and heterocycles. Chemical science, 2018, 9, 2284-2289 |
| 1548702 | CIF | C29 H25 N O3 S | P 1 21 1 | 9.769; 13.123; 10.039 90; 114.345; 90 | 1172.5 | Zhou, Leijie; Yuan, Chunhao; Zeng, Yuan; Liu, Honglei; Wang, Chang; Gao, Xing; Wang, Qijun; Zhang, Cheng; Guo, Hongchao Phosphine-catalyzed [5+1] annulation of δ-sulfonamido-substituted enones with <i>N</i>-sulfonylimines: a facile synthesis of tetrahydropyridines. Chemical science, 2018, 9, 1831-1835 |
| 1548722 | CIF | C12 H15 O P | P 21 21 21 | 8.6681; 10.3977; 11.4123 90; 90; 90 | 1028.57 | Zhang, Kui; Cai, Lingchao; Yang, Zhongyue; Houk, K. N.; Kwon, Ohyun Bridged [2.2.1] bicyclic phosphine oxide facilitates catalytic γ-umpolung addition-Wittig olefination. Chemical science, 2018, 9, 1867-1872 |
| 1548723 | CIF | C26 H49 O3 Sc Si2 | P 1 21 1 | 8.2245; 17.776; 10.845 90; 109.79; 90 | 1491.9 | Yan, Xinwen; Zhang, Shaowen; Peng, Deqian; Zhang, Pengfei; Zhi, Junge; Wu, Xiaolu; Wang, Lin; Dong, Yuping; Li, Xiaofang Cationic half-sandwich rare-earth metal alkyl species catalyzed polymerization and copolymerization of aryl isocyanides possessing polar, bulky, or chiral substituents Polymer Chemistry, 2018, 9, 984 |
| 1548724 | CIF | C26 H49 Lu O3 Si2 | P 1 21 1 | 8.2286; 17.857; 10.889 90; 109.76; 90 | 1505.8 | Yan, Xinwen; Zhang, Shaowen; Peng, Deqian; Zhang, Pengfei; Zhi, Junge; Wu, Xiaolu; Wang, Lin; Dong, Yuping; Li, Xiaofang Cationic half-sandwich rare-earth metal alkyl species catalyzed polymerization and copolymerization of aryl isocyanides possessing polar, bulky, or chiral substituents Polymer Chemistry, 2018, 9, 984 |
| 1548725 | CIF | C28 H53 Lu O3 Si2 | P 1 21/n 1 | 13.3321; 15.5971; 16.0371 90; 104.67; 90 | 3226.1 | Yan, Xinwen; Zhang, Shaowen; Peng, Deqian; Zhang, Pengfei; Zhi, Junge; Wu, Xiaolu; Wang, Lin; Dong, Yuping; Li, Xiaofang Cationic half-sandwich rare-earth metal alkyl species catalyzed polymerization and copolymerization of aryl isocyanides possessing polar, bulky, or chiral substituents Polymer Chemistry, 2018, 9, 984 |
| 1548738 | CIF | Cl Co H15 N7 O5 | P n m a | 14.6048; 7.4486; 9.5237 90; 90; 90 | 1036.04 | Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science, 2018, 9, 2319-2335 |
| 1548739 | CIF | Cl Co H15 N7 O5 | P n m a | 14.7295; 7.3639; 9.5828 90; 90; 90 | 1039.41 | Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science, 2018, 9, 2319-2335 |
| 1548740 | CIF | Cl Co H15 N7 O5 | P n m a | 14.7688; 7.3395; 9.5973 90; 90; 90 | 1040.31 | Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science, 2018, 9, 2319-2335 |
| 1548741 | CIF | Cl Co H15 N7 O5 | P n m a | 14.5868; 7.4684; 9.513 90; 90; 90 | 1036.35 | Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science, 2018, 9, 2319-2335 |
| 1548742 | CIF | Cl Co H15 N7 O5 | P n m a | 14.471; 7.5428; 9.4556 90; 90; 90 | 1032.1 | Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science, 2018, 9, 2319-2335 |
| 1548743 | CIF | Cl Co H15 N7 O5 | P n m a | 14.7589; 7.348; 9.5909 90; 90; 90 | 1040.12 | Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science, 2018, 9, 2319-2335 |
| 1548744 | CIF | Cl Co H15 N7 O5 | P n m a | 14.5467; 7.4933; 9.4931 90; 90; 90 | 1034.77 | Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science, 2018, 9, 2319-2335 |
| 1548745 | CIF | Cl Co H15 N7 O5 | P n m a | 14.6615; 7.4138; 9.5536 90; 90; 90 | 1038.45 | Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science, 2018, 9, 2319-2335 |
| 1548746 | CIF | Cl Co H15 N7 O5 | P n m a | 14.7005; 7.3877; 9.5676 90; 90; 90 | 1039.07 | Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science, 2018, 9, 2319-2335 |
| 1548747 | CIF | Cl Co H15 N7 O5 | P n m a | 14.6166; 7.4465; 9.5286 90; 90; 90 | 1037.12 | Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science, 2018, 9, 2319-2335 |
| 1548748 | CIF | Cl Co H15 N7 O5 | P n m a | 14.4836; 7.5409; 9.4574 90; 90; 90 | 1032.93 | Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science, 2018, 9, 2319-2335 |
| 1548749 | CIF | Cl Co H15 N7 O5 | P n m a | 14.8308; 7.2957; 9.6188 90; 90; 90 | 1040.76 | Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies. Chemical science, 2018, 9, 2319-2335 |
| 1548752 | CIF | C34 H33 F4 Mg N3 | P c a 21 | 24.8934; 13.45834; 18.5282 90; 90; 90 | 6207.39 | Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science, 2018, 9, 2348-2356 |
| 1548753 | CIF | C58.5 H81 Mg N4 Zn | P -1 | 11.7887; 12.0703; 21.6822 80.152; 74.593; 66.945 | 2729 | Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science, 2018, 9, 2348-2356 |
| 1548754 | CIF | C81 H115 F3 Mg3 N6 | P -1 | 14.5708; 14.6964; 18.2421 91.379; 93.348; 91.651 | 3896.7 | Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science, 2018, 9, 2348-2356 |
| 1548755 | CIF | C35.5 H36.5 F4 Mg N3 | P -1 | 11.8799; 16.0457; 17.2413 83.738; 85.661; 88.935 | 3257.4 | Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science, 2018, 9, 2348-2356 |
| 1548756 | CIF | C59 H84 Mg N6 Zn | C 1 2/c 1 | 10.18598; 24.1833; 23.1663 90; 99.0832; 90 | 5635.01 | Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science, 2018, 9, 2348-2356 |
| 1548757 | CIF | C46 H58 Mg N4 Zn | P 1 2/n 1 | 13.4443; 8.2978; 19.6313 90; 102.544; 90 | 2137.75 | Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science, 2018, 9, 2348-2356 |
| 1548758 | CIF | C46.5 H56 F4 N3 Zn | I 1 2/a 1 | 15.6052; 24.2499; 23.5838 90; 102.23; 90 | 8722.1 | Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science, 2018, 9, 2348-2356 |
| 1548759 | CIF | C56 H78 Mg N4 O Zn | P 1 21/n 1 | 12.3877; 22.4084; 19.0461 90; 90.149; 90 | 5287 | Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science, 2018, 9, 2348-2356 |
| 1548760 | CIF | C65 H99 Al Mg N4 | I 1 2/a 1 | 21.9257; 15.7003; 37.0659 90; 97.8995; 90 | 12638.5 | Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science, 2018, 9, 2348-2356 |
| 1548761 | CIF | C58 H82 N4 Zn3 | P 1 21/n 1 | 12.7429; 17.3446; 13.026 90; 101.313; 90 | 2823.07 | Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science, 2018, 9, 2348-2356 |
| 1548762 | CIF | C54 H75 Al N4 Zn | P 21 21 21 | 13.75991; 13.8927; 26.733 90; 90; 90 | 5110.34 | Bakewell, Clare; Ward, Bryan J.; White, Andrew J. P.; Crimmin, Mark R. A combined experimental and computational study on the reaction of fluoroarenes with Mg-Mg, Mg-Zn, Mg-Al and Al-Zn bonds. Chemical science, 2018, 9, 2348-2356 |
| 1548769 | CIF | C17 H19 Cl O4 | P 21 21 21 | 6.9832; 8.5007; 26.483 90; 90; 90 | 1572.1 | Ngamnithiporn, Aurapat; Jette, Carina I.; Bachman, Shoshana; Virgil, Scott C.; Stoltz, Brian M. Nickel-catalyzed enantioselective allylic alkylation of lactones and lactams with unactivated allylic alcohols. Chemical science, 2018, 9, 2547-2551 |
| 1548770 | CIF | C17 H6 Cl7 N2 | P 1 21/n 1 | 8.7015; 14.84; 14.86 90; 105.517; 90 | 1848.9 | Kimura, Shun; Tanushi, Akira; Kusamoto, Tetsuro; Kochi, Shuntaro; Sato, Tohru; Nishihara, Hiroshi A luminescent organic radical with two pyridyl groups: high photostability and dual stimuli-responsive properties, with theoretical analyses of photophysical processes. Chemical science, 2018, 9, 1996-2007 |
| 1548829 | CIF | C260 H338 Au42 S26 | P -1 | 24.328; 24.845; 32.217 67.732; 76.94; 84.496 | 17553 | Zhuang, Shengli; Liao, Lingwen; Zhao, Yan; Yuan, Jinyun; Yao, Chuanhao; Liu, Xu; Li, Jin; Deng, Haiteng; Yang, Jinlong; Wu, Zhikun Is the kernel-staples match a key-lock match? Chemical science, 2018, 9, 2437-2442 |
| 1548838 | CIF | C18 H26 N4 O6 S | P 1 | 7.4225; 16.5812; 21.1102 82.789; 85.375; 84.403 | 2559.1 | Lee, Jisun; Joullié, Madeleine M Total synthesis of the reported structure of ceanothine D <i>via</i> a novel macrocyclization strategy. Chemical science, 2018, 9, 2432-2436 |
| 1548839 | CIF | C21 H23 Ni0.5 O4 | P 1 21/n 1 | 9.6006; 15.4568; 11.7534 90; 93.542; 90 | 1740.8 | Vijaykumar, Gonela; Pariyar, Anand; Ahmed, Jasimuddin; Shaw, Bikash Kumar; Adhikari, Debashis; Mandal, Swadhin K. Tuning the redox non-innocence of a phenalenyl ligand toward efficient nickel-assisted catalytic hydrosilylation. Chemical science, 2018, 9, 2817-2825 |
| 1548853 | CIF | C23 H26 N2 O2 S2 | P -1 | 7.4148; 10.3516; 14.6348 82.054; 79.877; 73.007 | 1053.02 | Suzuki, Naoya; Suda, Kayo; Yokogawa, Daisuke; Kitoh-Nishioka, Hirotaka; Irle, Stephan; Ando, Akihiro; Abegão, Luis M G; Kamada, Kenji; Fukazawa, Aiko; Yamaguchi, Shigehiro Near infrared two-photon-excited and -emissive dyes based on a strapped excited-state intramolecular proton-transfer (ESIPT) scaffold. Chemical science, 2018, 9, 2666-2673 |
| 1548854 | CIF | C25 H30 N2 O2 S2 | P 1 21/a 1 | 10.7685; 14.2394; 16.386 90; 108.759; 90 | 2379.1 | Suzuki, Naoya; Suda, Kayo; Yokogawa, Daisuke; Kitoh-Nishioka, Hirotaka; Irle, Stephan; Ando, Akihiro; Abegão, Luis M G; Kamada, Kenji; Fukazawa, Aiko; Yamaguchi, Shigehiro Near infrared two-photon-excited and -emissive dyes based on a strapped excited-state intramolecular proton-transfer (ESIPT) scaffold. Chemical science, 2018, 9, 2666-2673 |
| 1548856 | CIF | C44 H36 N2 | P 1 21/c 1 | 8.6947; 17.563; 10.737 90; 97.361; 90 | 1626.1 | Sun, Xianglang; Xue, Qifan; Zhu, Zonglong; Xiao, Qi; Jiang, Kui; Yip, Hin-Lap; Yan, He; Li, Zhong'an Fluoranthene-based dopant-free hole transporting materials for efficient perovskite solar cells. Chemical science, 2018, 9, 2698-2704 |
| 1548857 | CIF | C46 H34 N4 O4 | P 1 21/c 1 | 14.1565; 17.917; 14.4208 90; 99.826; 90 | 3604.1 | Sun, Xianglang; Xue, Qifan; Zhu, Zonglong; Xiao, Qi; Jiang, Kui; Yip, Hin-Lap; Yan, He; Li, Zhong'an Fluoranthene-based dopant-free hole transporting materials for efficient perovskite solar cells. Chemical science, 2018, 9, 2698-2704 |
| 1548858 | CIF | C46 H34 N4 | P -1 | 11.856; 12.147; 13.446 102.687; 111.422; 93.005 | 1739.8 | Sun, Xianglang; Xue, Qifan; Zhu, Zonglong; Xiao, Qi; Jiang, Kui; Yip, Hin-Lap; Yan, He; Li, Zhong'an Fluoranthene-based dopant-free hole transporting materials for efficient perovskite solar cells. Chemical science, 2018, 9, 2698-2704 |
| 1548860 | CIF | C42 H36.34 N O2.17 P | P 21 21 21 | 13.9558; 15.4622; 30.6296 90; 90; 90 | 6609.5 | Ardkhean, Ruchuta; Mortimore, Mike; Paton, Robert S.; Fletcher, Stephen P. Formation of quaternary centres by copper catalysed asymmetric conjugate addition to β-substituted cyclopentenones with the aid of a quantitative structure-selectivity relationship. Chemical science, 2018, 9, 2628-2632 |
| 1548861 | CIF | C22 H20 Cl F6 N | P 1 21 1 | 11.4023; 8.446; 12.168 90; 117.387; 90 | 1040.49 | Ardkhean, Ruchuta; Mortimore, Mike; Paton, Robert S.; Fletcher, Stephen P. Formation of quaternary centres by copper catalysed asymmetric conjugate addition to β-substituted cyclopentenones with the aid of a quantitative structure-selectivity relationship. Chemical science, 2018, 9, 2628-2632 |
| 1548862 | CIF | C24 H30 Cl N | P 21 21 21 | 8.332; 11.3877; 22.1875 90; 90; 90 | 2105.2 | Ardkhean, Ruchuta; Mortimore, Mike; Paton, Robert S.; Fletcher, Stephen P. Formation of quaternary centres by copper catalysed asymmetric conjugate addition to β-substituted cyclopentenones with the aid of a quantitative structure-selectivity relationship. Chemical science, 2018, 9, 2628-2632 |
| 1548863 | CIF | C46.5 H39 Cl N O2 P | P 1 21 1 | 13.9275; 18.6673; 15.2746 90; 110.757; 90 | 3713.47 | Ardkhean, Ruchuta; Mortimore, Mike; Paton, Robert S.; Fletcher, Stephen P. Formation of quaternary centres by copper catalysed asymmetric conjugate addition to β-substituted cyclopentenones with the aid of a quantitative structure-selectivity relationship. Chemical science, 2018, 9, 2628-2632 |
| 1548864 | CIF | C42.45 H36.9 Cl0.9 N O2 P | P 21 21 2 | 24.2085; 16.0031; 8.8283 90; 90; 90 | 3420.18 | Ardkhean, Ruchuta; Mortimore, Mike; Paton, Robert S.; Fletcher, Stephen P. Formation of quaternary centres by copper catalysed asymmetric conjugate addition to β-substituted cyclopentenones with the aid of a quantitative structure-selectivity relationship. Chemical science, 2018, 9, 2628-2632 |
| 1548865 | CIF | C50 H82 B Cl N6 Ni O2 Si2 | C 1 2/c 1 | 27.8322; 21.4898; 26.4066 90; 116.468; 90 | 14138.5 | Hadlington, T. J.; Szilvási, T; Driess, M. Striking transformations of the hydroborylene ligand in a HB:\ρightarrow Ni<sup>II</sup> complex with isocyanides and CO. Chemical science, 2018, 9, 2595-2600 |
| 1548866 | CIF | C44 H71 B Cl N5 Ni O3 Si2 | P 1 21/c 1 | 10.8782; 25.2119; 17.866 90; 91.948; 90 | 4897.1 | Hadlington, T. J.; Szilvási, T; Driess, M. Striking transformations of the hydroborylene ligand in a HB:\ρightarrow Ni<sup>II</sup> complex with isocyanides and CO. Chemical science, 2018, 9, 2595-2600 |
| 1548867 | CIF | C38 H63 B Cl N5 O2 | P -1 | 9.8905; 12.6054; 16.945 69.66; 89.159; 78.594 | 1938.4 | Hadlington, T. J.; Szilvási, T; Driess, M. Striking transformations of the hydroborylene ligand in a HB:→ Ni<sup>II</sup> complex with isocyanides and CO. Chemical science, 2018, 9, 2595-2600 |
| 1548868 | CIF | C66 H105 B Cl N6 Ni O6 Si2 | P -1 | 11.0148; 14.6131; 22.793 84.552; 83.601; 70.398 | 3428.1 | Hadlington, T. J.; Szilvási, T; Driess, M. Striking transformations of the hydroborylene ligand in a HB:\ρightarrow Ni<sup>II</sup> complex with isocyanides and CO. Chemical science, 2018, 9, 2595-2600 |
| 1548869 | CIF | C27 H49 B Cl N5 | P 1 21/n 1 | 13.7173; 15.3059; 15.7157 90; 110.275; 90 | 3095.16 | Hadlington, T. J.; Szilvási, T; Driess, M. Striking transformations of the hydroborylene ligand in a HB:\ρightarrow Ni<sup>II</sup> complex with isocyanides and CO. Chemical science, 2018, 9, 2595-2600 |
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