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Information card for entry 8104999
Preview
| Coordinates | 8104999.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H58 Cl2 Cu N12 |
|---|---|
| Calculated formula | C36 H58 Cl2 Cu N12 |
| Title of publication | The crystal structure of hexakis(1-isopropyl-1H-imidazole-κ1N)copper(II) dichloride, C36H58Cl2CuN12 |
| Authors of publication | Cheng, Miao; Cheng, Shuang |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2019 |
| Journal volume | 235 |
| Journal issue | 1 |
| Pages of publication | 11 - 13 |
| a | 8.149 ± 0.0008 Å |
| b | 17.0301 ± 0.0015 Å |
| c | 16.8649 ± 0.0014 Å |
| α | 90° |
| β | 101.629 ± 0.003° |
| γ | 90° |
| Cell volume | 2292.4 ± 0.4 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 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 | 0.0717 |
| Residual factor for significantly intense reflections | 0.0419 |
| Weighted residual factors for significantly intense reflections | 0.0988 |
| Weighted residual factors for all reflections included in the refinement | 0.1121 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.994 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 274299 (current) | 2022-04-04 | cif/ Adding structures of 8104999 via cif-deposit CGI script. |
8104999.cif |
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Users of the data should acknowledge the original authors of the
structural data.