Information card for entry 2217197

Structure parameters

• Chemical name: 2-Chloro-<i>N</i>-(2,6-dimethylphenyl)acetamide
• Formula: C10 H12 Cl N O
• Calculated formula: C10 H12 Cl N O
• SMILES: ClCC(=O)Nc1c(cccc1C)C
• Title of publication: 2-Chloro-<i>N</i>-(2,6-dimethylphenyl)acetamide
• Authors of publication: B. Thimme Gowda; Sabine Foro; Ingrid Svoboda; Helmut Paulus; Hartmut Fuess
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 1
• Pages of publication: o286 - o286
• a: 13.766 ± 0.003 Å
• b: 8.911 ± 0.002 Å
• c: 8.538 ± 0.002 Å
• α: 90°
• β: 99 ± 0.01°
• γ: 90°
• Cell volume: 1034.5 ± 0.4 ų
• Cell temperature: 300 ± 2 K
• Ambient diffraction temperature: 300 ± 2 K
• Number of distinct elements: 5
• 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: 0.0431
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.0988
• Weighted residual factors for all reflections included in the refinement: 0.1037
• Goodness-of-fit parameter for all reflections included in the refinement: 1.101
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes