Information card for entry 2217196

Structure parameters

• Chemical name: <i>N</i>-(3,4-Dimethylphenyl)acetamide
• Formula: C10 H13 N O
• Calculated formula: C10 H13 N O
• SMILES: O=C(Nc1cc(c(cc1)C)C)C
• Title of publication: <i>N</i>-(3,4-Dimethylphenyl)acetamide
• Authors of publication: B. Thimme Gowda; Sabine Foro; Hartmut Fuess
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 1
• Pages of publication: o11 - o11
• a: 6.749 ± 0.001 Å
• b: 14.281 ± 0.002 Å
• c: 15.005 ± 0.002 Å
• α: 85.33 ± 0.01°
• β: 79.81 ± 0.01°
• γ: 87.58 ± 0.01°
• Cell volume: 1418.1 ± 0.3 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0955
• Residual factor for significantly intense reflections: 0.064
• Weighted residual factors for significantly intense reflections: 0.1843
• Weighted residual factors for all reflections included in the refinement: 0.2095
• 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: No
• Has Fobs: Yes