Information card for entry 2232607

Structure parameters

• Chemical name: <i>N</i>-(2,3-Dimethylphenyl)-2-methylbenzamide
• Formula: C16 H17 N O
• Calculated formula: C16 H17 N O
• SMILES: c1(c(c(ccc1)C)C)NC(=O)c1c(cccc1)C
• Title of publication: <i>N</i>-(2,3-Dimethylphenyl)-2-methylbenzamide
• Authors of publication: Rodrigues, Vinola Z.; Gowda, B. Thimme; Sivý, Július; Vrábel, Viktor; Kožíšek, Jozef
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 12
• Pages of publication: o3496
• a: 5.8092 ± 0.0004 Å
• b: 4.9253 ± 0.0002 Å
• c: 23.1887 ± 0.0012 Å
• α: 90°
• β: 94.229 ± 0.005°
• γ: 90°
• Cell volume: 661.67 ± 0.06 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 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: 0.0735
• Residual factor for significantly intense reflections: 0.0675
• Weighted residual factors for significantly intense reflections: 0.2037
• Weighted residual factors for all reflections included in the refinement: 0.2078
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes