Information card for entry 7251939
| Formula |
Cs Cu5 I O10 P2 |
| Calculated formula |
Cs1.0002 Cu5.02 I O10 P2 |
| Title of publication |
Subtle symmetry breaking in averievite-related compounds, (MX)Cu5O2(VO4)2 (MX = CsBr, CsI, RbBr, RbI and KI) |
| Authors of publication |
Kornyakov, Ilya V.; Bubnova, Olga; Kalinichev, Alexey A.; Likholetova, Marina V.; Krivovichev, Sergey V. |
| Journal of publication |
CrystEngComm |
| Year of publication |
2026 |
| a |
6.26222 ± 0.00015 Å |
| b |
6.26222 ± 0.00015 Å |
| c |
8.2422 ± 0.0002 Å |
| α |
90° |
| β |
90° |
| γ |
120° |
| Cell volume |
279.918 ± 0.012 Å3 |
| Cell temperature |
296 ± 2 K |
| Ambient diffraction temperature |
296 ± 2 K |
| Number of distinct elements |
5 |
| Space group number |
164 |
| Hermann-Mauguin space group symbol |
P -3 m 1 |
| Hall space group symbol |
-P 3 2" |
| Residual factor for all reflections |
0.012 |
| Residual factor for significantly intense reflections |
0.0097 |
| Weighted residual factors for significantly intense reflections |
0.024 |
| Weighted residual factors for all reflections included in the refinement |
0.0244 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.082 |
| Diffraction radiation probe |
x-ray |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/7251939.html
