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Information card for entry 2002998
Preview
| Coordinates | 2002998.cif |
|---|---|
| Original IUCr paper | HTML |
| Formula | C57 H52 Cl O2 Os P3 |
|---|---|
| Calculated formula | C57 H51 Cl O2 Os P3 |
| Title of publication | Refinement of Twinned Structures with <i>SHELXL</i>97 |
| Authors of publication | Herbst-Irmer, Regine; Sheldrick, George M. |
| Journal of publication | Acta Crystallographica Section B |
| Year of publication | 1998 |
| Journal volume | 54 |
| Journal issue | 4 |
| Pages of publication | 443 - 449 |
| a | 12.623 ± 0.002 Å |
| b | 12.623 ± 0.002 Å |
| c | 26.325 ± 0.005 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 3632.7 ± 1.1 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 144 |
| Hermann-Mauguin space group symbol | P 31 |
| Hall space group symbol | P 31 |
| Residual factor for all reflections | 0.0589 |
| Residual factor for significantly intense reflections | 0.0462 |
| Weighted residual factors for all reflections included in the refinement | 0.1019 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.067 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
structural data.