Information card for entry 2218416

Structure parameters

• Chemical name: 2-Chloro-<i>N</i>-phenylacetamide
• Formula: C8 H8 Cl N O
• Calculated formula: C8 H8 Cl N O
• SMILES: ClCC(=O)Nc1ccccc1
• Title of publication: 2-Chloro-<i>N</i>-phenylacetamide
• Authors of publication: Gowda, B. Thimme; Kožíšek, Jozef; Tokarčík, Miroslav; Fuess, Hartmut
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 6
• Pages of publication: o987
• a: 5.0623 ± 0.0015 Å
• b: 18.361 ± 0.006 Å
• c: 9.115 ± 0.002 Å
• α: 90°
• β: 102.13 ± 0.03°
• γ: 90°
• Cell volume: 828.3 ± 0.4 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.1496
• Residual factor for significantly intense reflections: 0.0361
• Weighted residual factors for significantly intense reflections: 0.0661
• Weighted residual factors for all reflections included in the refinement: 0.0857
• Goodness-of-fit parameter for all reflections included in the refinement: 0.958
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes