Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1513872 | CIF | C17 H17 O5 P | P 21 21 21 | 6.6316; 9.2654; 26.038 90; 90; 90 | 1599.9 | Xu, Bin; Zhu, Shou-Fei; Zhang, Zhi-Chao; Yu, Zhi-Xiang; Ma, Yi; Zhou, Qi-Lin Highly enantioselective S–H bond insertion cooperatively catalyzed by dirhodium complexes and chiral spiro phosphoric acids Chemical Science, 2014, 5, 1442 |
| 1513873 | CIF | C29 H25 O5 P | C 1 2 1 | 25.33; 6.664; 16.09 90; 121.291; 90 | 2320.9 | Xu, Bin; Zhu, Shou-Fei; Zhang, Zhi-Chao; Yu, Zhi-Xiang; Ma, Yi; Zhou, Qi-Lin Highly enantioselective S–H bond insertion cooperatively catalyzed by dirhodium complexes and chiral spiro phosphoric acids Chemical Science, 2014, 5, 1442 |
| 1513874 | CIF | C56 H83 O7 P | P 1 21 1 | 11.779; 17.451; 13.849 90; 110.544; 90 | 2665.7 | Xu, Bin; Zhu, Shou-Fei; Zhang, Zhi-Chao; Yu, Zhi-Xiang; Ma, Yi; Zhou, Qi-Lin Highly enantioselective S–H bond insertion cooperatively catalyzed by dirhodium complexes and chiral spiro phosphoric acids Chemical Science, 2014, 5, 1442 |
| 1513875 | CIF | C70 H66 Cl2 O19 P4 Rh2 | P 21 21 21 | 16.527; 18.866; 26.157 90; 90; 90 | 8156 | Xu, Bin; Zhu, Shou-Fei; Zhang, Zhi-Chao; Yu, Zhi-Xiang; Ma, Yi; Zhou, Qi-Lin Highly enantioselective S‒H bond insertion cooperatively catalyzed by dirhodium complexes and chiral spiro phosphoric acids Chemical Science, 2014, 5, 1442 |
| 1513876 | CIF | C27 H27 Er N4 O3 | P -3 c 1 | 12.9479; 12.9479; 16.3112 90; 90; 120 | 2368.18 | Pedersen, Kasper S.; Ungur, Liviu; Sigrist, Marc; Sundt, Alexander; Schau-Magnussen, Magnus; Vieru, Veacheslav; Mutka, Hannu; Rols, Stephane; Weihe, Høgni; Waldmann, Oliver; Chibotaru, Liviu F.; Bendix, Jesper; Dreiser, Jan Modifying the properties of 4f single-ion magnets by peripheral ligand functionalisation Chemical Science, 2014, 5, 1650 |
| 1513877 | CIF | C30 H30 Er I3 N4 O3 | P -3 | 13.0245; 13.0245; 11.15 90; 90; 120 | 1638 | Pedersen, Kasper S.; Ungur, Liviu; Sigrist, Marc; Sundt, Alexander; Schau-Magnussen, Magnus; Vieru, Veacheslav; Mutka, Hannu; Rols, Stephane; Weihe, Høgni; Waldmann, Oliver; Chibotaru, Liviu F.; Bendix, Jesper; Dreiser, Jan Modifying the properties of 4f single-ion magnets by peripheral ligand functionalisation Chemical Science, 2014, 5, 1650 |
| 1513878 | CIF | C27 H24 Cl3 Er N4 O3 | P 1 21/n 1 | 12.5689; 15.0967; 14.9942 90; 109.98; 90 | 2673.89 | Pedersen, Kasper S.; Ungur, Liviu; Sigrist, Marc; Sundt, Alexander; Schau-Magnussen, Magnus; Vieru, Veacheslav; Mutka, Hannu; Rols, Stephane; Weihe, Høgni; Waldmann, Oliver; Chibotaru, Liviu F.; Bendix, Jesper; Dreiser, Jan Modifying the properties of 4f single-ion magnets by peripheral ligand functionalisation Chemical Science, 2014, 5, 1650 |
| 1513879 | CIF | C30 H29 N4 O2 | P -1 | 9.489; 10.75; 13.644 90.055; 94.092; 111.778 | 1288.6 | Jia, Wenbin; Yang, Peng; Li, Junjie; Yin, Zhengmao; Kong, Lin; Lu, Hongbo; Ge, Zhishen; Wu, Yongzhong; Hao, Xiaopeng; Yang, Jiaxiang Synthesis and characterization of a novel cyanostilbene derivative and its initiated polymers: aggregation-induced emission enhancement behaviors and light-emitting diode applications Polymer Chemistry, 2014, 5, 2282 |
| 1513880 | CIF | Li Mn O2 | P m 2 m | 2.804; 5.758; 4.576 90; 90; 90 | 73.881 | Dittrich, G.; Hoppe, R. Zur Kristallstruktur von LiMnO~2~ Zeitschrift für Anorganische und Allgemeine Chemie, 1969, 368, 262-270 |
| 1513881 | CIF | F5 Fe K2 | P n m a | 7.3964; 5.6779; 11.5445 90; 90; 90 | 484.82 | Le Bail, Armel On two new K~2~FeF~5~ forms Powder Diffraction, 2014, 29, 33-41 |
| 1513882 | CIF | F5 Fe K2 | C 1 2/m 1 | 13.0919; 5.7311; 7.3114 90; 118.241; 90 | 483.281 | Le Bail, Armel On two new K~2~FeF~5~ forms Powder Diffraction, 2014, 29, 33-41 |
| 1513883 | CIF | C38 H29.5 B2 Co F8 N6 O0.5 | P -1 | 11.1961; 12.9138; 14.3453 81.2415; 75.9587; 68.5142 | 1867.7 | Liu, Li; Zhang, Xu; Liu, Heng; Zhang, Xuequan; Sun, Guangping; Zhang, Hexin Synthesis of cationic cobalt(II) complexes and their efficiency as catalysts for the polymerization of 1,3-butadiene Inorganica Chimica Acta, 2014, 414, 8-14 |
| 1513884 | CIF | C31 H31 B2 Co F8 N8 | P -1 | 10.3908; 10.6832; 19.3985 87.055; 75.488; 71.841 | 1980 | Liu, Li; Zhang, Xu; Liu, Heng; Zhang, Xuequan; Sun, Guangping; Zhang, Hexin Synthesis of cationic cobalt(II) complexes and their efficiency as catalysts for the polymerization of 1,3-butadiene Inorganica Chimica Acta, 2014, 414, 8-14 |
| 1513885 | CIF | C27 H23 Cl2 Co N4 | P -1 | 10.7724; 10.8378; 10.9523 85.642; 84.435; 78.643 | 1245.6 | Liu, Li; Zhang, Xu; Liu, Heng; Zhang, Xuequan; Sun, Guangping; Zhang, Hexin Synthesis of cationic cobalt(II) complexes and their efficiency as catalysts for the polymerization of 1,3-butadiene Inorganica Chimica Acta, 2014, 414, 8-14 |
| 1513886 | CIF | C14 H12 N8 Ni Zn | C 1 2/m 1 | 16.611; 7.4997; 6.6052 90; 96.612; 90 | 817.4 | Gör, Kansu; Kürkçüoğlu, Güneş Süheyla; Yeşilel, Okan Zafer; Büyükgüngör, Orhan Syntheses, crystal structures and spectroscopic properties of cyano-bridged two-dimensional coordination polymers with 3-methylpyridazine Inorganica Chimica Acta, 2014, 414, 15-20 |
| 1513887 | CIF | C14 H12 Cd N8 Ni | C 1 2/m 1 | 16.611; 7.4997; 6.6052 90; 96.612; 90 | 817.4 | Gör, Kansu; Kürkçüoğlu, Güneş Süheyla; Yeşilel, Okan Zafer; Büyükgüngör, Orhan Syntheses, crystal structures and spectroscopic properties of cyano-bridged two-dimensional coordination polymers with 3-methylpyridazine Inorganica Chimica Acta, 2014, 414, 15-20 |
| 1513888 | CIF | C14 H12 Cd N8 Pd | C 1 2/m 1 | 16.8405; 7.8819; 6.8858 90; 98.692; 90 | 903.49 | Gör, Kansu; Kürkçüoğlu, Güneş Süheyla; Yeşilel, Okan Zafer; Büyükgüngör, Orhan Syntheses, crystal structures and spectroscopic properties of cyano-bridged two-dimensional coordination polymers with 3-methylpyridazine Inorganica Chimica Acta, 2014, 414, 15-20 |
| 1513889 | CIF | C14 H12 N8 Pd Zn | C 1 2/m 1 | 16.5772; 7.6763; 6.7095 90; 96.446; 90 | 848.4 | Gör, Kansu; Kürkçüoğlu, Güneş Süheyla; Yeşilel, Okan Zafer; Büyükgüngör, Orhan Syntheses, crystal structures and spectroscopic properties of cyano-bridged two-dimensional coordination polymers with 3-methylpyridazine Inorganica Chimica Acta, 2014, 414, 15-20 |
| 1513890 | CIF | C14 H12 N8 Pt Zn | C 1 2/m 1 | 16.5949; 7.6623; 6.7225 90; 96.021; 90 | 850.08 | Gör, Kansu; Kürkçüoğlu, Güneş Süheyla; Yeşilel, Okan Zafer; Büyükgüngör, Orhan Syntheses, crystal structures and spectroscopic properties of cyano-bridged two-dimensional coordination polymers with 3-methylpyridazine Inorganica Chimica Acta, 2014, 414, 15-20 |
| 1513891 | CIF | C14 H12 Cd N8 Pt | C 1 2/m 1 | 16.8396; 7.8749; 6.9033 90; 98.057; 90 | 906.41 | Gör, Kansu; Kürkçüoğlu, Güneş Süheyla; Yeşilel, Okan Zafer; Büyükgüngör, Orhan Syntheses, crystal structures and spectroscopic properties of cyano-bridged two-dimensional coordination polymers with 3-methylpyridazine Inorganica Chimica Acta, 2014, 414, 15-20 |
| 1513892 | CIF | C19 H18 Fe2 I2 O4 Si | P -1 | 8.693; 9.234; 16.569 90.565; 104.378; 112.942 | 1177.9 | Zhu, Bo-Lin; Hao, Xiao-Ting; Shi, Wei Structures and reactivity of doubly-bridged dicyclopentadienyl dinuclear iron complexes Inorganica Chimica Acta, 2014, 414, 21-26 |
| 1513893 | CIF | C26 H26 Cl2 Fe2 O3 Si2 | P 1 21/c 1 | 19.536; 9.562; 14.828 90; 91.853; 90 | 2768.5 | Zhu, Bo-Lin; Hao, Xiao-Ting; Shi, Wei Structures and reactivity of doubly-bridged dicyclopentadienyl dinuclear iron complexes Inorganica Chimica Acta, 2014, 414, 21-26 |
| 1513894 | CIF | C18 H18 Fe2 O4 Si2 | C 1 2/c 1 | 14.927; 9.3697; 15.002 90; 117.638; 90 | 1858.8 | Zhu, Bo-Lin; Hao, Xiao-Ting; Shi, Wei Structures and reactivity of doubly-bridged dicyclopentadienyl dinuclear iron complexes Inorganica Chimica Acta, 2014, 414, 21-26 |
| 1513895 | CIF | C34.5 H45 Cl N8 O4 Tb | P -1 | 9.229; 13.79; 14.984 86.64; 72.5; 88.62 | 1816 | Gusev, Alexey N.; Hasegawa, Miki; Shimizu, Tomohito; Fukawa, Tomonori; Sakurai, Shoya; Nishchymenko, Galyna A.; Shul'gin, Victor F.; Meshkova, Svetlana B.; Linert, Wolfgang Synthesis, structure and luminescence studies of Eu(III), Tb(III), Sm(III), Dy(III) cationic complexes with acetylacetone and bis(5-(pyridine-2-yl)-1,2,4-triazol-3-yl)propane Inorganica Chimica Acta, 2013, 406, 279-284 |
| 1513896 | CIF | C26 H28 Cu F2 N4 O2 S2 | I 41/a :2 | 19.894; 19.894; 13.562 90; 90; 90 | 5367.4 | Liu, Huanhuan; Yang, Wen; Zhou, Weiqun; Xu, Yunlong; Xie, Juan; Li, Mengying Crystal structures and antimicrobial activities of copper(II) complexes of fluorine-containing thioureido ligands Inorganica Chimica Acta, 2013, 405, 387-394 |
| 1513897 | CIF | C26 H28 Cu F2 N4 O2 S2 | P -1 | 8.346; 8.575; 10.271 100.237; 107.28; 106.761 | 643.6 | Liu, Huanhuan; Yang, Wen; Zhou, Weiqun; Xu, Yunlong; Xie, Juan; Li, Mengying Crystal structures and antimicrobial activities of copper(II) complexes of fluorine-containing thioureido ligands Inorganica Chimica Acta, 2013, 405, 387-394 |
| 1513898 | CIF | C34 H30 Cu2 F4 N2 O10 | P 1 21/n 1 | 10.575; 10.434; 16.122 90; 93.338; 90 | 1775.9 | Liu, Huanhuan; Yang, Wen; Zhou, Weiqun; Xu, Yunlong; Xie, Juan; Li, Mengying Crystal structures and antimicrobial activities of copper(II) complexes of fluorine-containing thioureido ligands Inorganica Chimica Acta, 2013, 405, 387-394 |
| 1513899 | CIF | C45 H65 B N4 Ni2 O7 | P 1 21/c 1 | 14.569; 9.687; 33.624 90; 106.47; 90 | 4551 | Mochizuki, Katsura; Takahashi, Junpei Synthesis and structures of dinickel(II) complexes with a binucleating ligand, N,N'-bis[3-(N,N-dimethyl)aminopropyl]-N,N'-dimethyl-1,3-diamino-2-hydroxypropane (HL1), and investigation of carboxylic acid capture assisted by intramolecular hydrogen bonding Inorganica Chimica Acta, 2014, 414, 27-32 |
| 1513900 | CIF | C43 H61 B N4 Ni2 O5 | P -1 | 9.534; 15.236; 16.48 74.607; 77.69; 83.93 | 2251.9 | Mochizuki, Katsura; Takahashi, Junpei Synthesis and structures of dinickel(II) complexes with a binucleating ligand, N,N'-bis[3-(N,N-dimethyl)aminopropyl]-N,N'-dimethyl-1,3-diamino-2-hydroxypropane (HL1), and investigation of carboxylic acid capture assisted by intramolecular hydrogen bonding Inorganica Chimica Acta, 2014, 414, 27-32 |
| 1513901 | CIF | C48 H71 B N4 Ni2 O7 | P -1 | 10.932; 13.07; 18.723 72.14; 76.146; 82.73 | 2468.1 | Mochizuki, Katsura; Takahashi, Junpei Synthesis and structures of dinickel(II) complexes with a binucleating ligand, N,N'-bis[3-(N,N-dimethyl)aminopropyl]-N,N'-dimethyl-1,3-diamino-2-hydroxypropane (HL1), and investigation of carboxylic acid capture assisted by intramolecular hydrogen bonding Inorganica Chimica Acta, 2014, 414, 27-32 |
| 1513902 | CIF | C60 H71 B N4 Ni2 O7 | P 1 21/n 1 | 19.727; 12.982; 22.528 90; 99.673; 90 | 5687 | Mochizuki, Katsura; Takahashi, Junpei Synthesis and structures of dinickel(II) complexes with a binucleating ligand, N,N'-bis[3-(N,N-dimethyl)aminopropyl]-N,N'-dimethyl-1,3-diamino-2-hydroxypropane (HL1), and investigation of carboxylic acid capture assisted by intramolecular hydrogen bonding Inorganica Chimica Acta, 2014, 414, 27-32 |
| 1513903 | CIF | C43 H60 B N3 Ni2 O7 | P -1 | 12.192; 12.855; 15.418 87.75; 86.166; 67.343 | 2225 | Mochizuki, Katsura; Takahashi, Junpei Synthesis and structures of dinickel(II) complexes with a binucleating ligand, N,N'-bis[3-(N,N-dimethyl)aminopropyl]-N,N'-dimethyl-1,3-diamino-2-hydroxypropane (HL1), and investigation of carboxylic acid capture assisted by intramolecular hydrogen bonding Inorganica Chimica Acta, 2014, 414, 27-32 |
| 1513904 | CIF | C45 H64 B N3 Ni2 O9 | P -1 | 9.981; 14.789; 16.927 105.908; 90.358; 106.792 | 2291 | Mochizuki, Katsura; Takahashi, Junpei Synthesis and structures of dinickel(II) complexes with a binucleating ligand, N,N'-bis[3-(N,N-dimethyl)aminopropyl]-N,N'-dimethyl-1,3-diamino-2-hydroxypropane (HL1), and investigation of carboxylic acid capture assisted by intramolecular hydrogen bonding Inorganica Chimica Acta, 2014, 414, 27-32 |
| 1513905 | CIF | C22 H18 N3 O8 Re | P 1 21/c 1 | 8.3712; 14.8036; 18.193 90; 90.475; 90 | 2254.5 | 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. Clickable, Hydrophilic Ligand for fac-[M(I)(CO)3](+) (M = Re/(99m)Tc) Applied in an S-Functionalized α-MSH Peptide. Bioconjugate chemistry, 2014, 25, 579-592 |
| 1513906 | CIF | C36 H24 O6 | P 1 21/n 1 | 11.695; 18.236; 13.348 90; 108.795; 90 | 2694.9 | Gao, Qinghe; Wu, Xia; Liu, Shan; Wu, Anxin I2-Promoted Selective Oxidative Cross-Coupling/Annulation of 2-Naphthols with Methyl Ketones: A Strategy To Build Naphtho[2,1-b]furan-1(2H)-ones with a Quaternary Center. Organic letters, 2014, 16, 1732-1735 |
| 1513907 | CIF | C21 H16 O3 S | C 1 2/c 1 | 22.141; 9.7407; 18.082 90; 120.784; 90 | 3350.3 | Gao, Qinghe; Wu, Xia; Liu, Shan; Wu, Anxin I2-Promoted Selective Oxidative Cross-Coupling/Annulation of 2-Naphthols with Methyl Ketones: A Strategy To Build Naphtho[2,1-b]furan-1(2H)-ones with a Quaternary Center. Organic letters, 2014, 16, 1732-1735 |
| 1513908 | CIF | C75.32 H68.31 Cl1.98 N8 Ni2 O0.31 | P -1 | 11.636; 15.963; 19.746 102.414; 101.791; 108.945 | 3235.3 | Oda, Kazuma; Akita, Masanari; Hiroto, Satoru; Shinokubo, Hiroshi Silylethynyl substituents as porphyrin protecting groups for solubilization and selectivity control. Organic letters, 2014, 16, 1818-1821 |
| 1513909 | CIF | C15 H13 N O3 S | P 21 21 21 | 10.0289; 11.1264; 24.23 90; 90; 90 | 2703.7 | Arai, Takayoshi; Yamamoto, Yushi Diversity-Oriented Asymmetric Catalysis (DOAC): Stereochemically Divergent Synthesis of Thiochromanes Using an Imidazoline-Aminophenol-Nickel-Catalyzed Michael/Henry Reaction. Organic letters, 2014, 16, 1700-1703 |
| 1513910 | CIF | C19 H26 Cl N O5 | P n a 21 | 15.833; 10.199; 11.895 90; 90; 90 | 1920.8 | Ghavimi, Bahman; Magnus, Philip Total synthesis of 8,14-dihydromorphinandienone alkaloids. Organic letters, 2014, 16, 1708-1711 |
| 1513911 | CIF | C20 H21 N O7 | P -1 | 10.348; 10.853; 17.384 102.934; 93.21; 103.857 | 1835 | Ghavimi, Bahman; Magnus, Philip Total synthesis of 8,14-dihydromorphinandienone alkaloids. Organic letters, 2014, 16, 1708-1711 |
| 1513912 | CIF | C19 H20 O6 | P 21 21 21 | 7.8437; 13.259; 16.12 90; 90; 90 | 1676.5 | Ghavimi, Bahman; Magnus, Philip Total synthesis of 8,14-dihydromorphinandienone alkaloids. Organic letters, 2014, 16, 1708-1711 |
| 1513913 | CIF | C20 H23 N O7 | P -1 | 9.0867; 10.101; 11.628 70.291; 82.861; 67.216 | 926.3 | Ghavimi, Bahman; Magnus, Philip Total synthesis of 8,14-dihydromorphinandienone alkaloids. Organic letters, 2014, 16, 1708-1711 |
| 1513914 | CIF | C19 H20 O6 | P 1 21/n 1 | 12.166; 15.353; 19.159 90; 97.195; 90 | 3550.4 | Ghavimi, Bahman; Magnus, Philip Total synthesis of 8,14-dihydromorphinandienone alkaloids. Organic letters, 2014, 16, 1708-1711 |
| 1513915 | CIF | C20 H26 Cl N O5 | P 1 21/c 1 | 9.626; 15.695; 12.703 90; 100.641; 90 | 1886.2 | Ghavimi, Bahman; Magnus, Philip Total synthesis of 8,14-dihydromorphinandienone alkaloids. Organic letters, 2014, 16, 1708-1711 |
| 1513916 | CIF | C16 H17 N3 O2 | P 21 21 21 | 7.407; 11.2; 17.505 90; 90; 90 | 1452.2 | Li, Qiong; Zhang, Shu-Yu; He, Gang; Ai, Zhaoyan; Nack, William A.; Chen, Gong Copper-catalyzed carboxamide-directed ortho amination of anilines with alkylamines at room temperature. Organic letters, 2014, 16, 1764-1767 |
| 1513917 | CIF | C20 H19 N3 O2 | P -1 | 9.1774; 9.9179; 18.81 89.777; 88.17; 88.491 | 1710.6 | Li, Qiong; Zhang, Shu-Yu; He, Gang; Ai, Zhaoyan; Nack, William A.; Chen, Gong Copper-catalyzed carboxamide-directed ortho amination of anilines with alkylamines at room temperature. Organic letters, 2014, 16, 1764-1767 |
| 1513918 | CIF | C15 H16 N4 O2 | P 21 21 21 | 7.071; 11.759; 17.021 90; 90; 90 | 1415.3 | Li, Qiong; Zhang, Shu-Yu; He, Gang; Ai, Zhaoyan; Nack, William A.; Chen, Gong Copper-catalyzed carboxamide-directed ortho amination of anilines with alkylamines at room temperature. Organic letters, 2014, 16, 1764-1767 |
| 1513919 | CIF | C15 H16 N4 O2 | P 1 21/c 1 | 9.522; 15.626; 19.401 90; 92.289; 90 | 2884.4 | Li, Qiong; Zhang, Shu-Yu; He, Gang; Ai, Zhaoyan; Nack, William A.; Chen, Gong Copper-catalyzed carboxamide-directed ortho amination of anilines with alkylamines at room temperature. Organic letters, 2014, 16, 1764-1767 |
| 1513920 | CIF | C16 H16 Br N3 O2 | C 1 2/c 1 | 22.866; 7.402; 19.103 90; 101.646; 90 | 3166.7 | Li, Qiong; Zhang, Shu-Yu; He, Gang; Ai, Zhaoyan; Nack, William A.; Chen, Gong Copper-catalyzed carboxamide-directed ortho amination of anilines with alkylamines at room temperature. Organic letters, 2014, 16, 1764-1767 |
| 1513921 | CIF | C73 H132 N10 O17 | P 1 21 1 | 10.649; 19.364; 22.911 90; 100.61; 90 | 4644 | Sonti, Rajesh; Dinesh, Bhimareddy; Basuroy, Krishnayan; Raghothama, Srinivasarao; Shamala, Narayanaswamy; Balaram, Padmanabhan C12 Helices in Long Hybrid (αγ)n Peptides Composed Entirely of Unconstrained Residues with Proteinogenic Side Chains. Organic letters, 2014, 16, 1656-1659 |
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