Information card for entry 2000835

Structure parameters

• Formula: C9 H10 O3
• Calculated formula: C9 H10 O3
• SMILES: OC(=O)CCc1ccccc1O
• Title of publication: Structure of 3-(2-hydroxyphenyl)propionic acid
• Authors of publication: Begum, N. S.; Jain, M.; Chandrasekhar, S.; Venkatesan, K.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1992
• Journal volume: 48
• Journal issue: 6
• Pages of publication: 1076 - 1078
• a: 8.248 ± 0.001 Å
• b: 5.145 ± 0.002 Å
• c: 19.724 ± 0.002 Å
• α: 90°
• β: 90.67 ± 0.01°
• γ: 90°
• Cell volume: 836.9 ± 0.4 ų
• 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
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: Mo
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No