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Information card for entry 8104698
Preview
| Coordinates | 8104698.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C30 H32 N2 Ni O2 |
|---|---|
| Calculated formula | C30 H32 N2 Ni O2 |
| Title of publication | Crystal structure of bis{(2-pyridinyl)-1-phenyl-1-isopropylmethanolato-κ2 N,O}nickel, C30H32N2NiO2 |
| Authors of publication | Singh, Nijal K.; Soobramoney, Lynette; Shozi, Mzamo L.; Friedrich, Holger B.; Zamisa, Sizwe J. |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2021 |
| Journal volume | 236 |
| Journal issue | 4 |
| Pages of publication | 741 - 743 |
| a | 12.125 ± 0.0004 Å |
| b | 13.6413 ± 0.0004 Å |
| c | 8.1152 ± 0.0003 Å |
| α | 90° |
| β | 108.348 ± 0.002° |
| γ | 90° |
| Cell volume | 1274.02 ± 0.07 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 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 | 0.0353 |
| Residual factor for significantly intense reflections | 0.0285 |
| Weighted residual factors for significantly intense reflections | 0.0699 |
| Weighted residual factors for all reflections included in the refinement | 0.0711 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.027 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 273559 (current) | 2022-03-09 | cif/ Adding structures of 8104698 via cif-deposit CGI script. |
8104698.cif |
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Users of the data should acknowledge the original authors of the
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