Information card for entry 2219851

Structure parameters

• Chemical name: <i>N</i>-(3-Methylphenyl)benzamide
• Formula: C14 H13 N O
• Calculated formula: C14 H13 N O
• SMILES: Cc1cccc(c1)NC(=O)c1ccccc1
• Title of publication: <i>N</i>-(3-Methylphenyl)benzamide
• Authors of publication: Gowda, B. Thimme; Foro, Sabine; Sowmya, B. P.; Fuess, Hartmut
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 11
• Pages of publication: o2247
• a: 13.269 ± 0.002 Å
• b: 53.686 ± 0.006 Å
• c: 9.3921 ± 0.0012 Å
• α: 90°
• β: 134.21 ± 0.01°
• γ: 90°
• Cell volume: 4795.7 ± 1.4 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 4
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0632
• Residual factor for significantly intense reflections: 0.0435
• Weighted residual factors for significantly intense reflections: 0.1153
• Weighted residual factors for all reflections included in the refinement: 0.1287
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes