Information card for entry 2212556

Structure parameters

• Chemical name: N-(2-Pyridylcarbonyl)benzamide
• Formula: C13 H10 N2 O2
• Calculated formula: C13 H10 N2 O2
• SMILES: O=C(NC(=O)c1ccccc1)c1ncccc1
• Title of publication: <i>N</i>-(2-Pyridylcarbonyl)benzamide
• Authors of publication: Gilles Gasser; Stoeckli-Evans, Helen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 3
• Pages of publication: o1455 - o1456
• a: 11.4673 ± 0.0012 Å
• b: 13.8974 ± 0.0011 Å
• c: 6.9421 ± 0.0008 Å
• α: 90°
• β: 102.705 ± 0.013°
• γ: 90°
• Cell volume: 1079.2 ± 0.2 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 4
• 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: 0.0485
• Residual factor for significantly intense reflections: 0.0316
• Weighted residual factors for significantly intense reflections: 0.0748
• Weighted residual factors for all reflections included in the refinement: 0.0796
• Goodness-of-fit parameter for all reflections included in the refinement: 0.92
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes