Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2012121
Preview
| Coordinates | 2012121.cif |
|---|---|
| Original IUCr paper | HTML |
| Formula | Li3 O4 Sb |
|---|---|
| Calculated formula | Li3 O4 Sb |
| SMILES | [Sb]1([O-])([O-])O[Sb](O1)([O-])([O-])([O])[O].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+] |
| Title of publication | A comparison of the X-ray single-crystal structure of Li~3~SbO~4~ with the Rietveld refinement |
| Authors of publication | Bernès, Sylvain; Trujillo Tovar, Sonia; Castellanos R., María A. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2001 |
| Journal volume | 57 |
| Journal issue | 8 |
| Pages of publication | 883 - 884 |
| a | 5.1456 ± 0.0005 Å |
| b | 6.0794 ± 0.0005 Å |
| c | 5.1291 ± 0.0006 Å |
| α | 90° |
| β | 108.859 ± 0.008° |
| γ | 90° |
| Cell volume | 151.84 ± 0.03 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 13 |
| Hermann-Mauguin space group symbol | P 1 2/c 1 |
| Hall space group symbol | -P 2yc |
| Residual factor for all reflections | 0.0163 |
| Residual factor for significantly intense reflections | 0.0149 |
| Weighted residual factors for all reflections included in the refinement | 0.0355 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2012121.html
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.