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Information card for entry 8107015
Preview
| Coordinates | 8107015.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C26 H20 Br4 N8 Ni O3 |
|---|---|
| Calculated formula | C26 H20 Br4 N8 Ni O3 |
| Title of publication | Crystal structure of diaquabis(3-(3,5-dibromophenyl)-5-(pyridin-2-yl)-1,2,4-triazol-4-ido-κ2 N,N′)nickel(II) mono hydrate, C26H20Br4N8NiO3 |
| Authors of publication | Meng, Jiang Ping; Liu, Xuan Lin; Xu, Qiang |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2016 |
| Journal volume | 231 |
| Journal issue | 3 |
| Pages of publication | 811 - 813 |
| a | 13.76 ± 0.004 Å |
| b | 14.079 ± 0.004 Å |
| c | 16.317 ± 0.005 Å |
| α | 90° |
| β | 98.604 ± 0.006° |
| γ | 90° |
| Cell volume | 3125.5 ± 1.6 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 13 |
| Hermann-Mauguin space group symbol | P 1 2/c 1 |
| Hall space group symbol | -P 2yc |
| Residual factor for all reflections | 0.2223 |
| Residual factor for significantly intense reflections | 0.0719 |
| Weighted residual factors for significantly intense reflections | 0.1144 |
| Weighted residual factors for all reflections included in the refinement | 0.1376 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.19 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 282258 (current) | 2023-04-04 | cif/ Adding structures of 8107015 via cif-deposit CGI script. |
8107015.cif |
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Users of the data should acknowledge the original authors of the
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