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Information card for entry 2242153
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| Coordinates | 2242153.cif |
|---|---|
| Structure factors | 2242153.hkl |
| Original IUCr paper | HTML |
| Chemical name | Calcium dinickel(II) iron(III) tris(orthophosphate) |
|---|---|
| Formula | Ca Fe Ni2 O12 P3 |
| Calculated formula | Ca Fe Ni2 O12 P3 |
| Title of publication | Crystal structure of calcium dinickel(II) iron(III) tris(orthophosphate): CaNi~2~Fe(PO~4~)~3~ |
| Authors of publication | Ouaatta, Said; Assani, Abderrazzak; Saadi, Mohamed; El Ammari, Lahcen |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2017 |
| Journal volume | 73 |
| Journal issue | 6 |
| Pages of publication | 893 - 895 |
| a | 10.3126 ± 0.0003 Å |
| b | 13.1138 ± 0.0003 Å |
| c | 6.4405 ± 0.0002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 871 ± 0.04 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 74 |
| Hermann-Mauguin space group symbol | I m m a |
| Hall space group symbol | -I 2b 2 |
| Residual factor for all reflections | 0.0169 |
| Residual factor for significantly intense reflections | 0.0166 |
| Weighted residual factors for significantly intense reflections | 0.0442 |
| Weighted residual factors for all reflections included in the refinement | 0.0443 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.167 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 199128 (current) | 2017-07-25 | cif/ hkl/ Adding structures of 2242153 via cif-deposit CGI script. |
2242153.cif 2242153.hkl |
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Users of the data should acknowledge the original authors of the
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