Information card for entry 3500110

Structure parameters

• 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 ų
• 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