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Information card for entry 2003163
Preview
| Coordinates | 2003163.cif |
|---|---|
| Original IUCr paper | HTML |
| Formula | Br2 Cl2 Cr Cs H18 N6 O8 |
|---|---|
| Calculated formula | Br2 Cl2 Cr Cs H18 N6 O8 |
| Title of publication | Phase Transitions and Structures at 10, 92 and 293 K in Eight Trigonal Double Salts <i>M</i>^I^[<i>M</i>^III^(NH~3~)~6~](ClO~4~)~2~<i>X</i>~2~ |
| Authors of publication | Figgis, B. N.; Sobolev, A. N.; Reynolds, P. A. |
| Journal of publication | Acta Crystallographica Section B |
| Year of publication | 1998 |
| Journal volume | 54 |
| Journal issue | 5 |
| Pages of publication | 613 - 625 |
| a | 7.413 ± 0.001 Å |
| b | 7.413 ± 0.001 Å |
| c | 27.78 ± 0.007 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 1322.1 ± 0.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.0155 |
| Residual factor for significantly intense reflections | 0.015 |
| Weighted residual factors for all reflections included in the refinement | 0.0396 |
| 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 | No |
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