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Information card for entry 8103131
Preview
| Coordinates | 8103131.cif |
|---|---|
| External links | PubChem |
| Chemical name | bis(2-benzoylbenzoato - k2O,O')- (2,2'-bipyridine-k2N,N')cadmium(II), Cd(C10H8N2)(C14H9O3)2 |
|---|---|
| Formula | C38 H26 Cd N2 O6 |
| Calculated formula | C38 H26 Cd N2 O6 |
| Title of publication | Crystal structure of bis(2-benzoylbenzoato-k2O,O')-(2,2'-bipyridine-k2N,N')cadmium(II), Cd(C10H8N2)(C14H9O3)2 |
| Authors of publication | Ying-Qun Yang; Zhi-Min Chen; Wei Li; Yun-Fei Kuang |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2011 |
| Journal volume | 226 |
| Journal issue | 1 |
| Pages of publication | 112 |
| a | 13.385 ± 0.003 Å |
| b | 14.13 ± 0.003 Å |
| c | 17.139 ± 0.003 Å |
| α | 90° |
| β | 90.66 ± 0.03° |
| γ | 90° |
| Cell volume | 3241.3 ± 1.2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0366 |
| Residual factor for significantly intense reflections | 0.0301 |
| Weighted residual factors for significantly intense reflections | 0.0704 |
| Weighted residual factors for all reflections included in the refinement | 0.0762 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.769 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301880 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 8/ Each referenced PubChem compound corresponds to the full crystal structure. |
8103131.cif |
| 176728 | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8. |
8103131.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
8103131.cif |
| 29091 | 2011-11-02 | ../uploads/cif-deposit/cod/cif Adding structures of 8103131 via cif-deposit CGI script. |
8103131.cif |
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