Information card for entry 2214544

Structure parameters

• Common name: 4-Chloroacetanilide
• Chemical name: <i>N</i>-(4-Chlorophenyl)acetamide
• Formula: C8 H8 Cl N O
• Calculated formula: C8 H8 Cl N O
• SMILES: Clc1ccc(NC(=O)C)cc1
• Title of publication: <i>N</i>-(4-Chlorophenyl)acetamide: a redetermination
• Authors of publication: B. Thimme Gowda; Sabine Foro; Hartmut Fuess
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 8
• Pages of publication: o3392 - o3392
• a: 9.7163 ± 0.0007 Å
• b: 12.8528 ± 0.0009 Å
• c: 6.5282 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 815.25 ± 0.11 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0358
• Residual factor for significantly intense reflections: 0.0302
• Weighted residual factors for significantly intense reflections: 0.0795
• Weighted residual factors for all reflections included in the refinement: 0.0836
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes