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Information card for entry 2311130
Preview
| Coordinates | 2311130.cif |
|---|---|
| Original IUCr paper | HTML |
| External links | PubChem |
| Chemical name | Bis(acetylacetonato-κ^2^<i>O</i>,<i>O</i>')bis(pyridine-κ<i>N</i>)nickel(II) dihydrate |
|---|---|
| Formula | C20 H28 N2 Ni O6 |
| Calculated formula | C20 H28 N2 Ni O6 |
| Title of publication | Bis(acetyl-acetonato-κ(2)O,O')bis-(pyridine-κN)nickel(II) dihydrate. |
| Authors of publication | Boutebdja, Mehdi; Beghidja, Adel; Beghidja, Chahrazed |
| Journal of publication | Acta crystallographica. Section E, Structure reports online |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | Pt 2 |
| Pages of publication | m131 |
| a | 16.362 ± 0.005 Å |
| b | 14.476 ± 0.005 Å |
| c | 9.543 ± 0.005 Å |
| α | 90° |
| β | 91.51 ± 0.005° |
| γ | 90° |
| Cell volume | 2259.5 ± 1.6 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 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 | 0.0479 |
| Residual factor for significantly intense reflections | 0.0342 |
| Weighted residual factors for significantly intense reflections | 0.0903 |
| Weighted residual factors for all reflections included in the refinement | 0.1027 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301809 (current) | 2025-08-19 | Add cross-references to PubChem compounds in COD range 2/31/ Each referenced PubChem compound corresponds to the full crystal structure. |
2311130.cif |
| 245602 | 2019-12-25 | cif/ Adding structures of 2311130 via cif-deposit CGI script. |
2311130.cif |
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Users of the data should acknowledge the original authors of the
structural data.