Information card for entry 2011704

Structure parameters

• Chemical name: p-Formamidebenzoic acid
• Formula: C8 H7 N O3
• Calculated formula: C8 H7 N O3
• SMILES: O=CNc1ccc(cc1)C(=O)O
• Title of publication: <i>p</i>-Formamidobenzoic acid
• Authors of publication: Novoa de Armas, Héctor; Peeters, Oswald M.; Blaton, Norbert M.; De Ranter, Camiel J.; Xuárez Marill, Lisbet
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 1
• Pages of publication: 86 - 87
• a: 8.0595 ± 0.0007 Å
• b: 3.8631 ± 0.0002 Å
• c: 11.812 ± 0.001 Å
• α: 90°
• β: 90.16 ± 0.008°
• γ: 90°
• Cell volume: 367.76 ± 0.05 ų
• Cell temperature: 293 K
• Number of distinct elements: 4
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 c 1
• Hall space group symbol: P -2yc
• Residual factor for all reflections: 0.046
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for all reflections: 0.129
• Weighted residual factors for all reflections included in the refinement: 0.129
• Goodness-of-fit parameter for all reflections: 1.134
• Goodness-of-fit parameter for all reflections included in the refinement: 1.134
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes