Information card for entry 2221827

Structure parameters

• Chemical name: <i>N</i>-(2,3-Dimethylphenyl)acetamide
• Formula: C10 H13 N O
• Calculated formula: C10 H13 N O
• SMILES: c1(c(c(ccc1)C)C)NC(=O)C
• Title of publication: <i>N</i>-(2,3-Dimethylphenyl)acetamide
• Authors of publication: Gowda, B. Thimme; Foro, Sabine; Terao, Hiromitsu; Fuess, Hartmut
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 5
• Pages of publication: o964
• a: 4.7961 ± 0.0005 Å
• b: 12.385 ± 0.001 Å
• c: 15.475 ± 0.002 Å
• α: 90°
• β: 96.23 ± 0.01°
• γ: 90°
• Cell volume: 913.78 ± 0.17 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.123
• Residual factor for significantly intense reflections: 0.073
• Weighted residual factors for significantly intense reflections: 0.134
• Weighted residual factors for all reflections included in the refinement: 0.156
• Goodness-of-fit parameter for all reflections included in the refinement: 1.26
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes