Information card for entry 2217482

Structure parameters

• Chemical name: <i>N</i>-(3-Chlorophenyl)acetamide
• Formula: C8 H8 Cl N O
• Calculated formula: C8 H8 Cl N O
• SMILES: Clc1cc(NC(=O)C)ccc1
• Title of publication: <i>N</i>-(3-Chlorophenyl)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: 2
• Pages of publication: o381 - o381
• a: 4.8468 ± 0.0008 Å
• b: 18.562 ± 0.002 Å
• c: 18.852 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1696 ± 0.4 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1058
• Residual factor for significantly intense reflections: 0.0816
• Weighted residual factors for significantly intense reflections: 0.2032
• Weighted residual factors for all reflections included in the refinement: 0.2239
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes