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Information card for entry 2244015
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| Coordinates | 2244015.cif |
|---|---|
| Structure factors | 2244015.hkl |
| Original IUCr paper | HTML |
| Common name | sodium magnesium borosilicide |
|---|---|
| Chemical name | 3 sodium 1 magnesium 37 boron 9 silicon |
| Formula | B37 Mg Na3 Si9 |
| Calculated formula | B37 Mg Na3 Si9 |
| Title of publication | Na~3~MgB~37~Si~9~: an icosahedral B~12~ cluster framework containing {Si~8~} units |
| Authors of publication | Morito, Haruhiko; Ikeda, Takuji; Katsura, Yukari; Yamane, Hisanori |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2022 |
| Journal volume | 78 |
| Journal issue | 2 |
| a | 10.163 ± 0.0003 Å |
| b | 10.163 ± 0.0003 Å |
| c | 16.5742 ± 0.0006 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 1482.54 ± 0.08 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 166 |
| Hermann-Mauguin space group symbol | R -3 m :H |
| Hall space group symbol | -R 3 2" |
| Residual factor for all reflections | 0.039 |
| Residual factor for significantly intense reflections | 0.0353 |
| Weighted residual factors for significantly intense reflections | 0.0753 |
| Weighted residual factors for all reflections included in the refinement | 0.0761 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.309 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 272124 (current) | 2022-01-19 | cif/ hkl/ Adding structures of 2244015 via cif-deposit CGI script. |
2244015.cif 2244015.hkl |
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