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Information card for entry 8104974
Preview
| Coordinates | 8104974.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C9 H14 F12 N4 P2 |
|---|---|
| Calculated formula | C9 H14 F12 N4 P2 |
| Title of publication | Crystal structure of 1,1′-(methane-1,1-diyl)bis(3-methyl-1H-imidazol-3-ium) bis(hexafluoridophosphate), C9H14F12N4P2 |
| Authors of publication | Huang-Xian, Zhang; Kun, Yuan; Qi-Long, Du; Xu-Liang, Nie; Wan-Ming, Xiong |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2022 |
| Journal volume | 237 |
| Journal issue | 1 |
| Pages of publication | 109 - 111 |
| a | 5.8968 ± 0.0009 Å |
| b | 11.5554 ± 0.0018 Å |
| c | 12.994 ± 0.002 Å |
| α | 90° |
| β | 94.577 ± 0.002° |
| γ | 90° |
| Cell volume | 882.6 ± 0.2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 11 |
| Hermann-Mauguin space group symbol | P 1 21/m 1 |
| Hall space group symbol | -P 2yb |
| Residual factor for all reflections | 0.077 |
| Residual factor for significantly intense reflections | 0.0676 |
| Weighted residual factors for significantly intense reflections | 0.1943 |
| Weighted residual factors for all reflections included in the refinement | 0.202 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.095 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 274168 (current) | 2022-03-31 | cif/ Adding structures of 8104974 via cif-deposit CGI script. |
8104974.cif |
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Users of the data should acknowledge the original authors of the
structural data.