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Information card for entry 2200657
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| Coordinates | 2200657.cif |
|---|---|
| Structure factors | 2200657.hkl |
| Original IUCr paper | HTML |
| Chemical name | Diethylammonium diphenylphosphinate |
|---|---|
| Formula | C16 H22 N O2 P |
| Calculated formula | C16 H22 N O2 P |
| SMILES | P(=O)([O-])(c1ccccc1)c1ccccc1.[NH2+](CC)CC |
| Title of publication | Diethylammonium diphenylphosphinate |
| Authors of publication | Dorn, Hendrik; Lough, Alan J.; Manners, Ian |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2001 |
| Journal volume | 57 |
| Journal issue | 10 |
| Pages of publication | o928 - o929 |
| a | 12.4163 ± 0.0002 Å |
| b | 8.3038 ± 0.0002 Å |
| c | 16.4517 ± 0.0003 Å |
| α | 90° |
| β | 106.949 ± 0.001° |
| γ | 90° |
| Cell volume | 1622.54 ± 0.06 Å3 |
| Cell temperature | 150 ± 1 K |
| Ambient diffraction temperature | 150 ± 1 K |
| Number of distinct elements | 5 |
| 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 | 0.047 |
| Residual factor for significantly intense reflections | 0.0399 |
| Weighted residual factors for all reflections included in the refinement | 0.1059 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.028 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
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Users of the data should acknowledge the original authors of the
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