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Information card for entry 8105212
Preview
| Coordinates | 8105212.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C3 H15 Mg N7 O12 |
|---|---|
| Calculated formula | C3 H15 Mg N7 O12 |
| Title of publication | The crystal structure of hexaquamagnesium(II) (2,4-bis(nitroimino)-6-oxo-1,3,5-triazinane-1,3-diide), C3H15MgN7O12 |
| Authors of publication | Tong, Zhang; Guangyuan, Zhang; Zishuai, Xu; Jian, Ruan; Lizhen, Chen; Jianlong, Wang |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2022 |
| Journal volume | 237 |
| Journal issue | 2 |
| Pages of publication | 309 - 310 |
| a | 6.7755 ± 0.0002 Å |
| b | 9.8181 ± 0.0003 Å |
| c | 11.0775 ± 0.0004 Å |
| α | 87.717 ± 0.001° |
| β | 78.297 ± 0.001° |
| γ | 70.804 ± 0.001° |
| Cell volume | 681.18 ± 0.04 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 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 | 0.0493 |
| Residual factor for significantly intense reflections | 0.0382 |
| Weighted residual factors for significantly intense reflections | 0.0985 |
| Weighted residual factors for all reflections included in the refinement | 0.1083 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.074 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 275325 (current) | 2022-05-11 | cif/ Adding structures of 8105212 via cif-deposit CGI script. |
8105212.cif |
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Users of the data should acknowledge the original authors of the
structural data.