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Information card for entry 2243516
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| Coordinates | 2243516.cif |
|---|---|
| Structure factors | 2243516.hkl |
| Original IUCr paper | HTML |
| Chemical name | Sodium manganese indium tris(phosphate) (2.22/0.87/1.68) |
|---|---|
| Formula | In1.68 Mn0.87 Na2.22 O12 P3 |
| Calculated formula | In1.6886 Mn0.8552 Na2.2238 O12 P3 |
| Title of publication | Synthesis, crystal structure and charge-distribution validation of a new alluaudite-type phosphate, Na~2.22~Mn~0.87~In~1.68~(PO~4~)~3~ |
| Authors of publication | Badri, Abdessalem; Alvarez-Serrano, Inmaculada; Luisa López, María; Ben Amara, Mongi |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2020 |
| Journal volume | 76 |
| Journal issue | 8 |
| Pages of publication | 1369 - 1372 |
| a | 12.412 ± 0.002 Å |
| b | 12.855 ± 0.002 Å |
| c | 6.599 ± 0.001 Å |
| α | 90° |
| β | 114.727 ± 0.002° |
| γ | 90° |
| Cell volume | 956.4 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0215 |
| Residual factor for significantly intense reflections | 0.0212 |
| Weighted residual factors for significantly intense reflections | 0.0534 |
| Weighted residual factors for all reflections included in the refinement | 0.0535 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.308 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 254729 (current) | 2020-08-01 | cif/ hkl/ Adding structures of 2243516 via cif-deposit CGI script. |
2243516.cif 2243516.hkl |
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