Information card for entry 2216936

Structure parameters

• Chemical name: <i>N</i>-(4-Methylphenyl)benzamide
• Formula: C14 H13 N O
• Calculated formula: C14 H13 N O
• SMILES: C(=O)(c1ccccc1)Nc1ccc(cc1)C
• Title of publication: <i>N</i>-(4-Methylphenyl)benzamide
• Authors of publication: B. Thimme Gowda; Miroslav Tokarčík; Jozef Kožíšek; B. P. Sowmya
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 1
• Pages of publication: o83 - o83
• a: 9.1117 ± 0.0003 Å
• b: 9.8336 ± 0.0002 Å
• c: 26.0616 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2335.14 ± 0.13 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1052
• Residual factor for significantly intense reflections: 0.0348
• Weighted residual factors for significantly intense reflections: 0.0752
• Weighted residual factors for all reflections included in the refinement: 0.0839
• Goodness-of-fit parameter for all reflections included in the refinement: 0.815
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes