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Information card for entry 3500110
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| Coordinates | 3500110.cif |
|---|---|
| Structure factors | 3500110.hkl |
| Common name | Ethyl p-hydroxybenzoate |
|---|---|
| Chemical name | Ethyl 4-hydroxybenzoate |
| Formula | C9 H10 O3 |
| Calculated formula | C9 H10 O3 |
| Authors of publication | Thierry Maris |
| Journal of publication | Personal communication to COD |
| Year of publication | 2020 |
| a | 11.6586 ± 0.0007 Å |
| b | 13.1645 ± 0.0008 Å |
| c | 11.5326 ± 0.0007 Å |
| α | 90° |
| β | 109.128 ± 0.002° |
| γ | 90° |
| Cell volume | 1672.29 ± 0.18 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 K |
| Number of distinct elements | 3 |
| 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 | 0.0458 |
| Residual factor for significantly intense reflections | 0.0449 |
| Weighted residual factors for significantly intense reflections | 0.1177 |
| Weighted residual factors for all reflections included in the refinement | 0.1189 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.121 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.34139 Å |
| Diffraction radiation type | GaKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 251912 (current) | 2020-05-08 | cif/ hkl/ Adding structures of 3500110 via cif-deposit CGI script. |
3500110.cif 3500110.hkl |
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Users of the data should acknowledge the original authors of the
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