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Information card for entry 2007264
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| Coordinates | 2007264.cif |
|---|---|
| Structure factors | 2007264.hkl |
| Original IUCr paper | HTML |
| Chemical name | Triphenylphosphine sulfide |
|---|---|
| Formula | C18 H15 P S |
| Calculated formula | C18 H15 P S |
| Title of publication | Triphenylphosphine Sulfide: a Redetermination at 150K |
| Authors of publication | Foces-Foces, C.; Llamas-Saiz, A.L. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1998 |
| Journal volume | 54 |
| Journal issue | 5 |
| Pages of publication | IUC9800013 |
| a | 18.1623 ± 0.0007 Å |
| b | 9.5124 ± 0.0003 Å |
| c | 17.8745 ± 0.0007 Å |
| α | 90° |
| β | 106.063 ± 0.003° |
| γ | 90° |
| Cell volume | 2967.56 ± 0.19 Å3 |
| Cell temperature | 150 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.04 |
| Residual factor for significantly intense reflections | 0.036 |
| Weighted residual factors for all reflections | 0.045 |
| Weighted residual factors for significantly intense reflections | 0.043 |
| Goodness-of-fit parameter for all reflections | 0.989 |
| Goodness-of-fit parameter for significantly intense reflections | 0.99 |
| Diffraction radiation wavelength | 1.5418 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
Version history
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Users of the data should acknowledge the original authors of the
structural data.