Information card for entry 2228669

Structure parameters

• Common name: N-Mesitylformamide
• Chemical name: <i>N</i>-(2,4,6-Trimethylphenyl)formamide
• Formula: C10 H13 N O
• Calculated formula: C10 H13 N O
• SMILES: c1(c(cc(cc1C)C)C)NC=O
• Title of publication: <i>N</i>-(2,4,6-Trimethylphenyl)formamide
• Authors of publication: Landman, Marilé; van der Westhuizen, Belinda; Bezuidenhout, Daniela I.; Liles, David C.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 1
• Pages of publication: o120
• a: 8.0659 ± 0.0007 Å
• b: 15.9004 ± 0.0013 Å
• c: 8.429 ± 0.0007 Å
• α: 90°
• β: 119.361 ± 0.001°
• γ: 90°
• Cell volume: 942.17 ± 0.14 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0507
• Residual factor for significantly intense reflections: 0.0477
• Weighted residual factors for significantly intense reflections: 0.1352
• Weighted residual factors for all reflections included in the refinement: 0.1382
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes