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Information card for entry 2021106
Preview
| Coordinates | 2021106.cif |
|---|---|
| Structure factors | 2021106.hkl |
| Original IUCr paper | HTML |
| Chemical name | Rubidium copper trichloride |
|---|---|
| Formula | Cl3 Cu Rb |
| Calculated formula | Cl3 Cu Rb |
| Title of publication | ε-RbCuCl~3~, a new polymorph of rubidium copper trichloride: synthesis, structure and structural complexity |
| Authors of publication | Kornyakov, Ilya V.; Krivovichev, Sergey V.; Gurzhiy, Vladislav V.; Leoni, Matteo |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2018 |
| Journal volume | 74 |
| Journal issue | 5 |
| Pages of publication | 529 - 533 |
| a | 7.053 ± 0.003 Å |
| b | 11.864 ± 0.005 Å |
| c | 11.785 ± 0.006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 986.1 ± 0.8 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 20 |
| Hermann-Mauguin space group symbol | C 2 2 21 |
| Hall space group symbol | C 2c 2 |
| Residual factor for all reflections | 0.037 |
| Residual factor for significantly intense reflections | 0.0277 |
| Weighted residual factors for significantly intense reflections | 0.0416 |
| Weighted residual factors for all reflections included in the refinement | 0.0439 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.02 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 207537 (current) | 2018-04-30 | cif/ hkl/ Adding structures of 2021106 via cif-deposit CGI script. |
2021106.cif 2021106.hkl |
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Users of the data should acknowledge the original authors of the
structural data.