Information card for entry 2236951

Structure parameters

• Chemical name: 3-Hydroxy-2-methoxybenzamide
• Formula: C8 H9 N O3
• Calculated formula: C8 H9 N O3
• SMILES: O(c1c(cccc1O)C(=O)N)C
• Title of publication: 3-Hydroxy-2-methoxybenzamide
• Authors of publication: Wilbrand, Sabine; Neis, Christian; Hegetschweiler, Kaspar
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 12
• Pages of publication: o3494
• a: 5.6293 ± 0.0002 Å
• b: 10.1826 ± 0.0004 Å
• c: 13.2402 ± 0.0005 Å
• α: 90°
• β: 92.75 ± 0.001°
• γ: 90°
• Cell volume: 758.07 ± 0.05 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0346
• Residual factor for significantly intense reflections: 0.0302
• Weighted residual factors for significantly intense reflections: 0.0793
• Weighted residual factors for all reflections included in the refinement: 0.0828
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes