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Information card for entry 2108929
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| Coordinates | 2108929.cif |
|---|---|
| Structure factors | 2108929.hkl |
| Original paper (by DOI) | HTML |
| Common name | caesium nitrate |
|---|---|
| Chemical name | caesium nitrate |
| Formula | Cs N O3 |
| Calculated formula | Cs N1.0002 O2.9994 |
| Title of publication | Structure of the high-temperature phase of caesium nitrate – the importance of high-resolution data |
| Authors of publication | Fábry, Jan; Kučeráková, Monika; Dušek, Michal; Buixaderas, Elena; Hlinka, Jiří |
| Journal of publication | Acta Crystallographica Section B |
| Year of publication | 2022 |
| Journal volume | 78 |
| Journal issue | 2 |
| a | 4.5226 ± 0.0006 Å |
| b | 4.5226 ± 0.0006 Å |
| c | 4.5226 ± 0.0006 Å |
| α | 90 ± 0.012° |
| β | 90 ± 0.012° |
| γ | 90 ± 0.012° |
| Cell volume | 92.5 ± 0.02 Å3 |
| Cell temperature | 440 ± 5 K |
| Ambient diffraction temperature | 440 ± 5 K |
| Number of distinct elements | 3 |
| Space group number | 221 |
| Hermann-Mauguin space group symbol | P m -3 m |
| Hall space group symbol | -P 4 2 3 |
| Residual factor for all reflections | 0.022 |
| Residual factor for significantly intense reflections | 0.0144 |
| Weighted residual factors for significantly intense reflections | 0.0543 |
| Weighted residual factors for all reflections included in the refinement | 0.0588 |
| Goodness-of-fit parameter for significantly intense reflections | 2.18 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.87 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 273689 (current) | 2022-03-15 | cif/ hkl/ Adding structures of 2108929 via cif-deposit CGI script. |
2108929.cif 2108929.hkl |
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