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Information card for entry 2010658
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| Coordinates | 2010658.cif |
|---|---|
| Original IUCr paper | HTML |
| Chemical name | Triphenylphoshine |
|---|---|
| Formula | C18 H15 P |
| Calculated formula | C18 H15 P |
| SMILES | c1(ccccc1)P(c1ccccc1)c1ccccc1 |
| Title of publication | Triclinic polymorphs of triphenylphosphine and triphenylphosphine sulfide |
| Authors of publication | Ziemer, Burkhard; Rabis, Annegrit; Hans-Uwe Steinberger |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2000 |
| Journal volume | 56 |
| Journal issue | 2 |
| Pages of publication | e58 - e59 |
| a | 11.0306 ± 0.0019 Å |
| b | 15.111 ± 0.003 Å |
| c | 17.554 ± 0.003 Å |
| α | 84.38 ± 0.02° |
| β | 80.36 ± 0.02° |
| γ | 85.82 ± 0.02° |
| Cell volume | 2866 ± 0.9 Å3 |
| Cell temperature | 180 ± 2 K |
| Ambient diffraction temperature | 180 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0646 |
| Residual factor for significantly intense reflections | 0.0422 |
| Weighted residual factors for all reflections included in the refinement | 0.1114 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.919 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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