Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 8104998
Preview
| Coordinates | 8104998.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C11 H18 F12 N4 P2 |
|---|---|
| Calculated formula | C11 H18 F12 N4 P2 |
| Title of publication | Crystal structure of 1,1′-methylenebis(3-ethyl-1H-imidazol-3-ium) bis(hexafluorophosphate(V)), C11H18F12N4P2 |
| Authors of publication | Xiong, Wan-Ming; Chen, Jing; Zhao, Wen; Zhou, Yao-Hong; Jing, Chen; Nie, Xu-Liang |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2019 |
| Journal volume | 235 |
| Journal issue | 1 |
| Pages of publication | 7 - 9 |
| a | 14.975 ± 0.003 Å |
| b | 9.897 ± 0.002 Å |
| c | 13.525 ± 0.003 Å |
| α | 90° |
| β | 105.507 ± 0.003° |
| γ | 90° |
| Cell volume | 1931.5 ± 0.7 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 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 | 0.0951 |
| Residual factor for significantly intense reflections | 0.059 |
| Weighted residual factors for significantly intense reflections | 0.154 |
| Weighted residual factors for all reflections included in the refinement | 0.1843 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 274298 (current) | 2022-04-04 | cif/ Adding structures of 8104998 via cif-deposit CGI script. |
8104998.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.