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Information card for entry 7221791
Preview
Coordinates | 7221791.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C50 H36 Cl0 Co N10 O14 |
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Calculated formula | C50 H36 Co N10 O14 |
SMILES | [Co]12([n]3cccc(c3)NC(=O)c3cc(O)cc(c3)C(=O)Nc3cnccc3)([n]3cccc(c3)NC(=O)c3cc(O)cc(c3)C(=O)Nc3cnccc3)([n]3c(C(=O)O1)c(C(=O)O)ccc3)[n]1c(C(=O)O2)c(C(=O)O)ccc1 |
Title of publication | Polycarboxylate-directed various Co(ii) complexes based on a “V”-like bis-pyridyl-bis-amide derivative: construction, electrochemical and photocatalytic properties |
Authors of publication | Wang, Xiu-Li; Sha, Xiao-Ting; Liu, Guo-Cheng; Chen, Nai-Li; Tian, Yuan |
Journal of publication | CrystEngComm |
Year of publication | 2015 |
Journal volume | 17 |
Journal issue | 38 |
Pages of publication | 7290 |
a | 8.658 ± 0.0006 Å |
b | 10.2661 ± 0.0007 Å |
c | 13.9044 ± 0.0009 Å |
α | 76.212 ± 0.001° |
β | 72.962 ± 0.001° |
γ | 72.097 ± 0.001° |
Cell volume | 1109.39 ± 0.13 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0411 |
Residual factor for significantly intense reflections | 0.0342 |
Weighted residual factors for significantly intense reflections | 0.0957 |
Weighted residual factors for all reflections included in the refinement | 0.1007 |
Goodness-of-fit parameter for all reflections included in the refinement | 1 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
176428 (current) | 2016-02-13 | Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively. |
7221791.cif |
171015 | 2015-12-09 | cif/ Updating files of 7221791, 7221792, 7221793, 7221794, 7221795, 7221796 Original log message: Adding full bibliography for 7221791--7221796.cif. |
7221791.cif |
153414 | 2015-08-14 | cif/ Adding structures of 7221791, 7221792, 7221793, 7221794, 7221795, 7221796 via cif-deposit CGI script. |
7221791.cif |
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