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Information card for entry 2108543
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| Coordinates | 2108543.cif |
|---|---|
| Structure factors | 2108543.hkl |
| Original paper (by DOI) | HTML |
| Common name | ammonium tantalum oxide fluoride |
|---|---|
| Formula | F7.66 H12 N3 O0.17 Ta |
| Calculated formula | F15.676 H3 N6 Ta1.998 |
| Title of publication | Ammonium tantalum oxide fluorides: new features of dynamic disorder |
| Authors of publication | Udovenko, Anatoly A.; Laptash, Natalia M. |
| Journal of publication | Acta Crystallographica Section B |
| Year of publication | 2019 |
| Journal volume | 75 |
| Journal issue | 6 |
| a | 8.5414 ± 0.0001 Å |
| b | 8.5414 ± 0.0001 Å |
| c | 41.4381 ± 0.0004 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 2618.11 ± 0.05 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.0365 |
| Residual factor for significantly intense reflections | 0.0345 |
| Weighted residual factors for significantly intense reflections | 0.1004 |
| Weighted residual factors for all reflections included in the refinement | 0.1014 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.188 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 231196 (current) | 2019-11-22 | cif/ hkl/ Adding structures of 2108542, 2108543, 2108544, 2108545 via cif-deposit CGI script. |
2108543.cif 2108543.hkl |
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Users of the data should acknowledge the original authors of the
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