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Information card for entry 2200086
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| Coordinates | 2200086.cif |
|---|---|
| Original IUCr paper | HTML |
| Formula | Ba Li Sb |
|---|---|
| Calculated formula | Ba Li Sb |
| SMILES | [Ba+2].[Sb-3].[Li+] |
| Title of publication | A new ternary antimonide phase, LiBaSb |
| Authors of publication | Monconduit, Laure; Belin, Claude |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2001 |
| Journal volume | 57 |
| Journal issue | 3 |
| Pages of publication | i17 - i18 |
| a | 4.8982 ± 0.001 Å |
| b | 4.8982 ± 0.001 Å |
| c | 9.014 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 187.29 ± 0.08 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 194 |
| Hermann-Mauguin space group symbol | P 63/m m c |
| Hall space group symbol | -P 6c 2c |
| Residual factor for all reflections | 0.0235 |
| Residual factor for significantly intense reflections | 0.0219 |
| Weighted residual factors for all reflections included in the refinement | 0.0546 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.083 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
structural data.