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Information card for entry 2003097
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| Coordinates | 2003097.cif |
|---|---|
| Original IUCr paper | HTML |
| Formula | Ca15 I O37 P9 |
|---|---|
| Calculated formula | Ca15 I1.048 O36.98 P9 |
| Title of publication | Iodo-oxyapatite, the first example from a new class of modulated apatites |
| Authors of publication | Alberius Henning, Peter; Lidin, Sven; Petříček, Vačlav |
| Journal of publication | Acta Crystallographica Section B |
| Year of publication | 1999 |
| Journal volume | 55 |
| Journal issue | 2 |
| Pages of publication | 165 - 169 |
| a | 9.567 ± 0.001 Å |
| b | 9.567 ± 0.001 Å |
| c | 20.754 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 1645.1 ± 0.3 Å3 |
| Cell temperature | 293 K |
| Number of distinct elements | 4 |
| Space group number | 176 |
| Hermann-Mauguin space group symbol | P 63/m |
| Hall space group symbol | -P 6c |
| Residual factor for all reflections | 0.0937 |
| Residual factor for significantly intense reflections | 0.0452 |
| Weighted residual factors for all reflections | 0.0545 |
| Weighted residual factors for significantly intense reflections | 0.0459 |
| Goodness-of-fit parameter for all reflections | 1.01 |
| Goodness-of-fit parameter for significantly intense reflections | 1.29 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
structural data.