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Information card for entry 8104560
Preview
| Coordinates | 8104560.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C13 H22 F12 N4 P2 |
|---|---|
| Calculated formula | C13 H22 F12 N4 P2 |
| Title of publication | Crystal structure of 1,1′-(methane-1,1-diyl)bis(3-propyl-1H-imidazol-3-ium) bis(hexafluoridophosphate), C13H22F12N4P2 |
| Authors of publication | Liu, Xin-Ting; Nie, Xu-Liang; Chen, Shi-Shun; Wu, Su-Qin; Xiong, Wan-Ming |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2021 |
| Journal volume | 236 |
| Journal issue | 6 |
| Pages of publication | 1179 - 1182 |
| a | 25.252 ± 0.003 Å |
| b | 8.3297 ± 0.0009 Å |
| c | 23.268 ± 0.002 Å |
| α | 90° |
| β | 116.271 ± 0.001° |
| γ | 90° |
| Cell volume | 4388.7 ± 0.8 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 | 0.1032 |
| Residual factor for significantly intense reflections | 0.0661 |
| Weighted residual factors for significantly intense reflections | 0.1859 |
| Weighted residual factors for all reflections included in the refinement | 0.2191 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 272880 (current) | 2022-02-09 | cif/ Adding structures of 8104560 via cif-deposit CGI script. |
8104560.cif |
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Users of the data should acknowledge the original authors of the
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