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Information card for entry 2022594
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| Coordinates | 2022594.cif |
|---|---|
| Structure factors | 2022594.hkl |
| Original IUCr paper | HTML |
| Common name | Sodium copper nickel phosphate |
|---|---|
| Chemical name | Sodium copper nickel diorthophosphate |
| Formula | Cu Na2 Ni O8 P2 |
| Calculated formula | Cu Na2 Ni O8 P2 |
| Title of publication | Novel first-row transition-metal phosphates: hydrothermal synthesis and crystal structures |
| Authors of publication | Kiriukhina, Galina V.; Yakubovich, Olga V.; Verchenko, Polina A.; Volkov, Anatoly S.; Dimitrova, Olga V. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2022 |
| Journal volume | 78 |
| Journal issue | 5 |
| a | 5.13 ± 0.0001 Å |
| b | 8.6729 ± 0.0002 Å |
| c | 6.8473 ± 0.0002 Å |
| α | 90° |
| β | 97.104 ± 0.003° |
| γ | 90° |
| Cell volume | 302.311 ± 0.013 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0303 |
| Residual factor for significantly intense reflections | 0.024 |
| Weighted residual factors for significantly intense reflections | 0.0607 |
| Weighted residual factors for all reflections included in the refinement | 0.0649 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.13 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 274469 (current) | 2022-04-12 | cif/ hkl/ Adding structures of 2022594, 2022595 via cif-deposit CGI script. |
2022594.cif 2022594.hkl |
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