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Information card for entry 8106143
Preview
| Coordinates | 8106143.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H22 N4 Ni O6 |
|---|---|
| Calculated formula | C18 H22 N4 Ni O6 |
| SMILES | [Ni]12([n]3c(C(=[N]1O)C)cccc3)([n]1c(C(=[N]2O)C)cccc1)(OC(=O)C)OC(=O)C |
| Title of publication | Crystal structure of bis(acetato-κO)-bis(1-(pyridin-2-yl)ethan-1-one oxime-κ2 N,N′)nickel(II), C18H22N4NiO6 |
| Authors of publication | Zuo, Jian |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2018 |
| Journal volume | 233 |
| Journal issue | 2 |
| Pages of publication | 329 - 330 |
| a | 9.3398 ± 0.0013 Å |
| b | 9.9707 ± 0.0011 Å |
| c | 12.0063 ± 0.0018 Å |
| α | 89.829 ± 0.003° |
| β | 71.931 ± 0.002° |
| γ | 74.243 ± 0.002° |
| Cell volume | 1019 ± 0.2 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0653 |
| Residual factor for significantly intense reflections | 0.0472 |
| Weighted residual factors for significantly intense reflections | 0.1183 |
| Weighted residual factors for all reflections included in the refinement | 0.1305 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.062 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 279363 (current) | 2022-11-17 | cif/ Adding structures of 8106143 via cif-deposit CGI script. |
8106143.cif |
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Users of the data should acknowledge the original authors of the
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