Crystallography Open Database
Search results
Result: there are 882 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 | archive of CIF files (ZIP)
Searching journal of publication like 'CrystEngComm' volume of publication is 10
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
7201551 | CIF | C13 H10 F N O | P 1 21/c 1 | 8.069; 5.3914; 23.238 90; 90.169; 90 | 1010.9 | Chopra, Deepak; Guru Row, T. N. Evaluation of the interchangeability of C‒H and C‒F groups: insights from crystal packing in a series of isomeric fluorinated benzanilides CrystEngComm, 2008, 10, 54 |
7201552 | CIF | C13 H10 F N O | P -1 | 5.349; 7.599; 12.945 92.124; 101.179; 90.162 | 515.8 | Chopra, Deepak; Guru Row, T. N. Evaluation of the interchangeability of C‒H and C‒F groups: insights from crystal packing in a series of isomeric fluorinated benzanilides CrystEngComm, 2008, 10, 54 |
7201553 | CIF | C13 H10 F N O | P 1 21 1 | 5.4206; 6.258; 15.534 90; 97.454; 90 | 522.5 | Chopra, Deepak; Guru Row, T. N. Evaluation of the interchangeability of C‒H and C‒F groups: insights from crystal packing in a series of isomeric fluorinated benzanilides CrystEngComm, 2008, 10, 54 |
7201554 | CIF | C13 H9 F2 N O | P 1 21/c 1 | 12.2353; 10.8787; 7.8648 90; 90.232; 90 | 1046.8 | Chopra, Deepak; Guru Row, T. N. Evaluation of the interchangeability of C‒H and C‒F groups: insights from crystal packing in a series of isomeric fluorinated benzanilides CrystEngComm, 2008, 10, 54 |
7201555 | CIF | C13 H9 F2 N O | P c a 21 | 24.66; 5.2031; 8.244 90; 90; 90 | 1057.8 | Chopra, Deepak; Guru Row, T. N. Evaluation of the interchangeability of C‒H and C‒F groups: insights from crystal packing in a series of isomeric fluorinated benzanilides CrystEngComm, 2008, 10, 54 |
7201556 | CIF | C13 H9 F2 N O | P 21 21 21 | 5.1864; 5.8673; 35.127 90; 90; 90 | 1068.9 | Chopra, Deepak; Guru Row, T. N. Evaluation of the interchangeability of C‒H and C‒F groups: insights from crystal packing in a series of isomeric fluorinated benzanilides CrystEngComm, 2008, 10, 54 |
7201557 | CIF | C13 H9 F2 N O | P -1 | 5.46; 7.693; 13.038 106.758; 100.371; 90.016 | 515 | Chopra, Deepak; Guru Row, T. N. Evaluation of the interchangeability of C‒H and C‒F groups: insights from crystal packing in a series of isomeric fluorinated benzanilides CrystEngComm, 2008, 10, 54 |
7201558 | CIF | C17 H24 Mg O15 | P 21 21 21 | 8.0984; 16.458; 16.621 90; 90; 90 | 2215.3 | Duan, Xianying; Lin, Jianguo; Li, Yizhi; Zhu, Chengjian; Meng, Qingjin Syntheses, structures and properties of a series of organic‒inorganic complexes based on methylenediisophthalic acid (H4MDIP) CrystEngComm, 2008, 10, 207 |
7201559 | CIF | C18 H28 Ca2 O17 | C 1 2/c 1 | 19.436; 13.549; 20.662 90; 116.932; 90 | 4851 | Duan, Xianying; Lin, Jianguo; Li, Yizhi; Zhu, Chengjian; Meng, Qingjin Syntheses, structures and properties of a series of organic‒inorganic complexes based on methylenediisophthalic acid (H4MDIP) CrystEngComm, 2008, 10, 207 |
7201560 | CIF | C17 H26 O17 Sr2 | P 1 21/c 1 | 10.852; 12.688; 17.865 90; 90.793; 90 | 2459.6 | Duan, Xianying; Lin, Jianguo; Li, Yizhi; Zhu, Chengjian; Meng, Qingjin Syntheses, structures and properties of a series of organic‒inorganic complexes based on methylenediisophthalic acid (H4MDIP) CrystEngComm, 2008, 10, 207 |
7201561 | CIF | C17 H28 Ba2 O18 | C 1 2/c 1 | 21.44; 13.16; 10.837 90; 119.847; 90 | 2652.1 | Duan, Xianying; Lin, Jianguo; Li, Yizhi; Zhu, Chengjian; Meng, Qingjin Syntheses, structures and properties of a series of organic‒inorganic complexes based on methylenediisophthalic acid (H4MDIP) CrystEngComm, 2008, 10, 207 |
7201562 | CIF | C34 H26 Mn2 O19 | P -1 | 7.3196; 10.067; 11.818 75.913; 75.671; 74.625 | 798.7 | Duan, Xianying; Lin, Jianguo; Li, Yizhi; Zhu, Chengjian; Meng, Qingjin Syntheses, structures and properties of a series of organic‒inorganic complexes based on methylenediisophthalic acid (H4MDIP) CrystEngComm, 2008, 10, 207 |
7201563 | CIF | C34 H26 Co2 O19 | P -1 | 7.2984; 9.985; 11.724 76.244; 75.392; 74.173 | 782.2 | Duan, Xianying; Lin, Jianguo; Li, Yizhi; Zhu, Chengjian; Meng, Qingjin Syntheses, structures and properties of a series of organic‒inorganic complexes based on methylenediisophthalic acid (H4MDIP) CrystEngComm, 2008, 10, 207 |
7201565 | CIF | C140 H90 N4 O18 Zn5 | P -1 | 14.013; 15.329; 15.464 67.147; 65.165; 83.999 | 2771.1 | Wang, Jun-Jie; Liu, Chun-Sen; Hu, Tong-Liang; Chang, Ze; Li, Cai-Yun; Yan, Li-Fen; Chen, Pei-Quan; Bu, Xian-He; Wu, Qiang; Zhao, Li-Juan; Wang, Zhe; Zhang, Xin-Zheng Zinc(ii) coordination architectures with two bulky anthracene-based carboxylic ligands: crystal structures and luminescent properties CrystEngComm, 2008, 10, 681 |
7201566 | CIF | C30 H24 O7 Zn | P 1 21/c 1 | 13.9951; 7.7039; 23.5124 90; 95.787; 90 | 2522.11 | Wang, Jun-Jie; Liu, Chun-Sen; Hu, Tong-Liang; Chang, Ze; Li, Cai-Yun; Yan, Li-Fen; Chen, Pei-Quan; Bu, Xian-He; Wu, Qiang; Zhao, Li-Juan; Wang, Zhe; Zhang, Xin-Zheng Zinc(ii) coordination architectures with two bulky anthracene-based carboxylic ligands: crystal structures and luminescent properties CrystEngComm, 2008, 10, 681 |
7201567 | CIF | C84 H54 N4 O9 Zn2 | C 1 2/c 1 | 22.62; 17.58; 18.07 90; 115.734; 90 | 6473 | Wang, Jun-Jie; Liu, Chun-Sen; Hu, Tong-Liang; Chang, Ze; Li, Cai-Yun; Yan, Li-Fen; Chen, Pei-Quan; Bu, Xian-He; Wu, Qiang; Zhao, Li-Juan; Wang, Zhe; Zhang, Xin-Zheng Zinc(ii) coordination architectures with two bulky anthracene-based carboxylic ligands: crystal structures and luminescent properties CrystEngComm, 2008, 10, 681 |
7201568 | CIF | C42 H34 N2 O6 Zn | C 1 2/c 1 | 24.168; 11.574; 12.0378 90; 94.489; 90 | 3356.9 | Wang, Jun-Jie; Liu, Chun-Sen; Hu, Tong-Liang; Chang, Ze; Li, Cai-Yun; Yan, Li-Fen; Chen, Pei-Quan; Bu, Xian-He; Wu, Qiang; Zhao, Li-Juan; Wang, Zhe; Zhang, Xin-Zheng Zinc(ii) coordination architectures with two bulky anthracene-based carboxylic ligands: crystal structures and luminescent properties CrystEngComm, 2008, 10, 681 |
7201569 | CIF | C46 H40 N2 O10 Zn | P b c a | 16.442; 17.697; 27.528 90; 90; 90 | 8010 | Wang, Jun-Jie; Liu, Chun-Sen; Hu, Tong-Liang; Chang, Ze; Li, Cai-Yun; Yan, Li-Fen; Chen, Pei-Quan; Bu, Xian-He; Wu, Qiang; Zhao, Li-Juan; Wang, Zhe; Zhang, Xin-Zheng Zinc(ii) coordination architectures with two bulky anthracene-based carboxylic ligands: crystal structures and luminescent properties CrystEngComm, 2008, 10, 681 |
7201570 | CIF | C44 H29 N4 O6 Zn | P 1 21/n 1 | 9.6712; 26.8053; 13.5499 90; 92.768; 90 | 3508.57 | Wang, Jun-Jie; Liu, Chun-Sen; Hu, Tong-Liang; Chang, Ze; Li, Cai-Yun; Yan, Li-Fen; Chen, Pei-Quan; Bu, Xian-He; Wu, Qiang; Zhao, Li-Juan; Wang, Zhe; Zhang, Xin-Zheng Zinc(ii) coordination architectures with two bulky anthracene-based carboxylic ligands: crystal structures and luminescent properties CrystEngComm, 2008, 10, 681 |
7201571 | CIF | C24 H17 N6 O2 Zn | P -1 | 9.5311; 10.77; 12.445 112.048; 95.725; 110.766 | 1066.4 | Wang, Jun-Jie; Liu, Chun-Sen; Hu, Tong-Liang; Chang, Ze; Li, Cai-Yun; Yan, Li-Fen; Chen, Pei-Quan; Bu, Xian-He; Wu, Qiang; Zhao, Li-Juan; Wang, Zhe; Zhang, Xin-Zheng Zinc(ii) coordination architectures with two bulky anthracene-based carboxylic ligands: crystal structures and luminescent properties CrystEngComm, 2008, 10, 681 |
7201572 | CIF | C36 H92 Er3 N9 O37 | P 21 21 21 | 17.9347; 18.1877; 18.3414 90; 90; 90 | 5982.8 | Zhu, Xiandong; Ma, Zhen; Bi, Wenhua; Wang, Yuling; Yuan, Daqiang; Cao, Rong Formation of a sandwich-type supercomplex through second-sphere coordination of functionalized macrocyclic polyamines CrystEngComm, 2008, 10, 19 |
7201573 | CIF | C34 H30 Cu2 N6 O20 S2 Sm2 | P -1 | 6.3467; 12.237; 13.363 97.447; 93.032; 95.62 | 1021.9 | Bo, Qi-Bing; Sun, Zhong-Xi; Forsling, Willis A new family of 3D 3d‒4f heterometallic frameworks comprising 1D inorganic lanthanide ladders and organic CuI-bipyridine chains CrystEngComm, 2008, 10, 232 |
7201574 | CIF | C34 H30 Cu2 Eu2 N6 O20 S2 | P -1 | 6.383; 12.333; 13.507 97.427; 93.019; 95.519 | 1047.2 | Bo, Qi-Bing; Sun, Zhong-Xi; Forsling, Willis A new family of 3D 3d‒4f heterometallic frameworks comprising 1D inorganic lanthanide ladders and organic CuI-bipyridine chains CrystEngComm, 2008, 10, 232 |
7201575 | CIF | C34 H30 Cu2 Gd2 N6 O20 S2 | P -1 | 12.648; 13.225; 14.475 87.804; 67.298; 66.926 | 2036.7 | Bo, Qi-Bing; Sun, Zhong-Xi; Forsling, Willis A new family of 3D 3d‒4f heterometallic frameworks comprising 1D inorganic lanthanide ladders and organic CuI-bipyridine chains CrystEngComm, 2008, 10, 232 |
7201576 | CIF | C34 H30 Cu2 Dy2 N6 O20 S2 | P -1 | 12.632; 13.234; 14.431 87.7; 67.347; 66.628 | 2025.5 | Bo, Qi-Bing; Sun, Zhong-Xi; Forsling, Willis A new family of 3D 3d‒4f heterometallic frameworks comprising 1D inorganic lanthanide ladders and organic CuI-bipyridine chains CrystEngComm, 2008, 10, 232 |
7201577 | CIF | C34 H30 Cu2 N6 O20 S2 Tb2 | P -1 | 12.624; 13.208; 14.457 87.744; 67.324; 66.785 | 2026 | Bo, Qi-Bing; Sun, Zhong-Xi; Forsling, Willis A new family of 3D 3d‒4f heterometallic frameworks comprising 1D inorganic lanthanide ladders and organic CuI-bipyridine chains CrystEngComm, 2008, 10, 232 |
7201578 | CIF | C30 H36 Cu N6 O6 | P n a 21 | 15.8279; 10.5692; 18.4677 90; 90; 90 | 3089.43 | Plater, M. John; Gelbrich, Thomas; Hursthouse, Michael B.; De Silva, Ben M. Interpenetrating three-dimensional coordination networks with a rare 4-connected (65.8) topology and unusual geometrical features CrystEngComm, 2008, 10, 125 |
7201579 | CIF | C30 H36 Co N6 O6 | P n a 21 | 15.7512; 10.2969; 18.7712 90; 90; 90 | 3044.47 | Plater, M. John; Gelbrich, Thomas; Hursthouse, Michael B.; De Silva, Ben M. Interpenetrating three-dimensional coordination networks with a rare 4-connected (65.8) topology and unusual geometrical features CrystEngComm, 2008, 10, 125 |
7201580 | CIF | C30 H36 N6 Ni O6 | P n a 21 | 16.0791; 10.1956; 18.9341 90; 90; 90 | 3103.98 | Plater, M. John; Gelbrich, Thomas; Hursthouse, Michael B.; De Silva, Ben M. Interpenetrating three-dimensional coordination networks with a rare 4-connected (65.8) topology and unusual geometrical features CrystEngComm, 2008, 10, 125 |
7201581 | CIF | C68 H90 Cu2 N12 O13 | P 1 21 1 | 10.1288; 21.0031; 16.3702 90; 90.961; 90 | 3482 | Plater, M. John; Gelbrich, Thomas; Hursthouse, Michael B.; De Silva, Ben M. Interpenetrating three-dimensional coordination networks with a rare 4-connected (65.8) topology and unusual geometrical features CrystEngComm, 2008, 10, 125 |
7201582 | CIF | C2 H5 N O2 | P 1 21/n 1 | 5.0866; 11.7731; 5.4595 90; 111.99; 90 | 303.157 | Netzel, Jeanette; Hofmann, Andreas; van Smaalen, Sander Accurate charge density of α-glycine by the maximum entropy method CrystEngComm, 2008, 10, 335 |
7201583 | CIF | C5 H6 O7 U | P 1 21 1 | 8.3067; 9.7312; 10.7272 90; 106.181; 90 | 832.77 | Thuéry, Pierre Novel two-dimensional uranyl‒organic assemblages in the citrate and d(‒)-citramalate families CrystEngComm, 2008, 10, 79 |
7201584 | CIF | C28 H56 N2 O24 U3 | P -1 | 8.498; 9.2992; 13.2045 86.048; 87.745; 88.381 | 1039.85 | Thuéry, Pierre Novel two-dimensional uranyl‒organic assemblages in the citrate and d(‒)-citramalate families CrystEngComm, 2008, 10, 79 |
7201585 | CIF | C22 H22 N2 O21 U3 | P 1 21/n 1 | 10.0669; 29.4919; 11.1076 90; 107.873; 90 | 3138.6 | Thuéry, Pierre Novel two-dimensional uranyl‒organic assemblages in the citrate and d(‒)-citramalate families CrystEngComm, 2008, 10, 79 |
7201586 | CIF | C132 H126 Fe2 O39 S96 | C 1 2/c 1 | 36.017; 30.88; 36.183 90; 93.66; 90 | 40161 | Martin, Lee; Day, Peter; Barnett, Sarah A.; Tocher, Derek A.; Horton, Peter N.; Hursthouse, Mike B. Magnetic molecular charge-transfer salts containing layers of water and tris(oxalato)ferrate(iii) anions CrystEngComm, 2008, 10, 192 |
7201587 | CIF | C66 H64 Fe O20 S48 | C 1 2/c 1 | 17.9695; 15.4988; 36.115 90; 93.72; 90 | 10037 | Martin, Lee; Day, Peter; Barnett, Sarah A.; Tocher, Derek A.; Horton, Peter N.; Hursthouse, Mike B. Magnetic molecular charge-transfer salts containing layers of water and tris(oxalato)ferrate(iii) anions CrystEngComm, 2008, 10, 192 |
7201588 | CIF | C20 H22 Co N6 O8 | P 1 21/n 1 | 8.4727; 14.4634; 18.4388 90; 94.748; 90 | 2251.8 | Du, Miao; Zhang, Zhi-Hui; You, Yan-Ping; Zhao, Xiao-Jun R-Isophthalate (R = ‒H, ‒NO2, and ‒COOH) as modular building blocks for mixed-ligand coordination polymers incorporated with a versatile connector 4-amino-3,5-bis(3-pyridyl)-1,2,4-triazole CrystEngComm, 2008, 10, 306 |
7201589 | CIF | C20 H19 Co N7 O9 | P -1 | 8.335; 10.926; 13.175 102.845; 99.713; 92.635 | 1148.7 | Du, Miao; Zhang, Zhi-Hui; You, Yan-Ping; Zhao, Xiao-Jun R-Isophthalate (R = ‒H, ‒NO2, and ‒COOH) as modular building blocks for mixed-ligand coordination polymers incorporated with a versatile connector 4-amino-3,5-bis(3-pyridyl)-1,2,4-triazole CrystEngComm, 2008, 10, 306 |
7201590 | CIF | C42 H42 Co N12 O18 | P -1 | 7.7168; 8.8342; 18.14 96.125; 101.533; 109.272 | 1123.7 | Du, Miao; Zhang, Zhi-Hui; You, Yan-Ping; Zhao, Xiao-Jun R-Isophthalate (R = ‒H, ‒NO2, and ‒COOH) as modular building blocks for mixed-ligand coordination polymers incorporated with a versatile connector 4-amino-3,5-bis(3-pyridyl)-1,2,4-triazole CrystEngComm, 2008, 10, 306 |
7201591 | CIF | C20 H18 Cu N6 O6 | P -1 | 9.0733; 10.0843; 12.3969 66.846; 89.438; 79.388 | 1022.62 | Du, Miao; Zhang, Zhi-Hui; You, Yan-Ping; Zhao, Xiao-Jun R-Isophthalate (R = ‒H, ‒NO2, and ‒COOH) as modular building blocks for mixed-ligand coordination polymers incorporated with a versatile connector 4-amino-3,5-bis(3-pyridyl)-1,2,4-triazole CrystEngComm, 2008, 10, 306 |
7201592 | CIF | C80 H76 Cu4 N28 O36 | P -1 | 15.987; 16.865; 18.229 95.956; 95.262; 110.902 | 4523 | Du, Miao; Zhang, Zhi-Hui; You, Yan-Ping; Zhao, Xiao-Jun R-Isophthalate (R = ‒H, ‒NO2, and ‒COOH) as modular building blocks for mixed-ligand coordination polymers incorporated with a versatile connector 4-amino-3,5-bis(3-pyridyl)-1,2,4-triazole CrystEngComm, 2008, 10, 306 |
7201593 | CIF | C21 H18 Cu N6 O8 | P 1 21/n 1 | 7.685; 14.817; 18.713 90; 93.509; 90 | 2127 | Du, Miao; Zhang, Zhi-Hui; You, Yan-Ping; Zhao, Xiao-Jun R-Isophthalate (R = ‒H, ‒NO2, and ‒COOH) as modular building blocks for mixed-ligand coordination polymers incorporated with a versatile connector 4-amino-3,5-bis(3-pyridyl)-1,2,4-triazole CrystEngComm, 2008, 10, 306 |
7201594 | CIF | C20 H19 Cd N6 O6.5 | P -1 | 7.3188; 10.3043; 14.2348 104.88; 92.569; 92.138 | 1035.15 | Du, Miao; Zhang, Zhi-Hui; You, Yan-Ping; Zhao, Xiao-Jun R-Isophthalate (R = ‒H, ‒NO2, and ‒COOH) as modular building blocks for mixed-ligand coordination polymers incorporated with a versatile connector 4-amino-3,5-bis(3-pyridyl)-1,2,4-triazole CrystEngComm, 2008, 10, 306 |
7201595 | CIF | C40 H38 Cd2 N14 O18 | P -1 | 9.1396; 13.754; 18.779 78.625; 87.997; 84.394 | 2302.9 | Du, Miao; Zhang, Zhi-Hui; You, Yan-Ping; Zhao, Xiao-Jun R-Isophthalate (R = ‒H, ‒NO2, and ‒COOH) as modular building blocks for mixed-ligand coordination polymers incorporated with a versatile connector 4-amino-3,5-bis(3-pyridyl)-1,2,4-triazole CrystEngComm, 2008, 10, 306 |
7201596 | CIF | C21 H22 Cd N6 O10 | C 1 2/c 1 | 22.16; 19.009; 13.457 90; 124.142; 90 | 4691.6 | Du, Miao; Zhang, Zhi-Hui; You, Yan-Ping; Zhao, Xiao-Jun R-Isophthalate (R = ‒H, ‒NO2, and ‒COOH) as modular building blocks for mixed-ligand coordination polymers incorporated with a versatile connector 4-amino-3,5-bis(3-pyridyl)-1,2,4-triazole CrystEngComm, 2008, 10, 306 |
7201597 | CIF | C12 H6 Ba N2 O5 | P 1 21/c 1 | 9.696; 19.241; 7.2146 90; 107.827; 90 | 1281.3 | Kelly, Niamh R.; Goetz, Sandrine; Batten, Stuart R.; Kruger, Paul E. Coordination behaviour and network formation with 4,4′,6,6′-tetracarboxy-2,2′-bipyridine and 4,4′-dicarboxy-2,2′-bipyridine ligands with rare and alkaline earth metals CrystEngComm, 2008, 10, 68 |
7201598 | CIF | C12 H8 N2 O5 Sr | C 1 c 1 | 17.2837; 9.9314; 7.0022 90; 97.464; 90 | 1191.75 | Kelly, Niamh R.; Goetz, Sandrine; Batten, Stuart R.; Kruger, Paul E. Coordination behaviour and network formation with 4,4′,6,6′-tetracarboxy-2,2′-bipyridine and 4,4′-dicarboxy-2,2′-bipyridine ligands with rare and alkaline earth metals CrystEngComm, 2008, 10, 68 |
7201599 | CIF | C14 H8 Ba2 N2 O10 | C 1 2/c 1 | 27.5898; 9.7108; 13.2117 90; 117.092; 90 | 3151.3 | Kelly, Niamh R.; Goetz, Sandrine; Batten, Stuart R.; Kruger, Paul E. Coordination behaviour and network formation with 4,4′,6,6′-tetracarboxy-2,2′-bipyridine and 4,4′-dicarboxy-2,2′-bipyridine ligands with rare and alkaline earth metals CrystEngComm, 2008, 10, 68 |
7201600 | CIF | C14 H10 Cu N2 O11 Sr | P -1 | 9.2075; 9.6199; 10.2189 107.787; 91.857; 115.389 | 764.46 | Kelly, Niamh R.; Goetz, Sandrine; Batten, Stuart R.; Kruger, Paul E. Coordination behaviour and network formation with 4,4′,6,6′-tetracarboxy-2,2′-bipyridine and 4,4′-dicarboxy-2,2′-bipyridine ligands with rare and alkaline earth metals CrystEngComm, 2008, 10, 68 |
7201601 | CIF | C14 H12 N2 O10 | P 1 2/c 1 | 9.0649; 7.1645; 11.7296 90; 102.472; 90 | 743.81 | Kelly, Niamh R.; Goetz, Sandrine; Batten, Stuart R.; Kruger, Paul E. Coordination behaviour and network formation with 4,4′,6,6′-tetracarboxy-2,2′-bipyridine and 4,4′-dicarboxy-2,2′-bipyridine ligands with rare and alkaline earth metals CrystEngComm, 2008, 10, 68 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!