Information card for entry 2218705

Structure parameters

• Chemical name: 2-Chloro-<i>N</i>-(4-fluorophenyl)acetamide
• Formula: C8 H7 Cl F N O
• Calculated formula: C8 H7 Cl F N O
• SMILES: ClCC(=O)Nc1ccc(F)cc1
• Title of publication: 2-Chloro-<i>N</i>-(4-fluorophenyl)acetamide
• Authors of publication: Kang, Si-shun; Zeng, Hai-su; Li, Hai-lin; Wang, Hai-bo
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 7
• Pages of publication: o1194
• a: 4.741 ± 0.0009 Å
• b: 20.062 ± 0.004 Å
• c: 8.986 ± 0.0018 Å
• α: 90°
• β: 99.6 ± 0.03°
• γ: 90°
• Cell volume: 842.7 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.066
• Residual factor for significantly intense reflections: 0.0462
• Weighted residual factors for significantly intense reflections: 0.1131
• Weighted residual factors for all reflections included in the refinement: 0.126
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes