Information card for entry 2219544

Structure parameters

• Chemical name: N-benzyl-2-(2,4-dichlorophenoxy)acetamide
• Formula: C15 H13 Cl2 N O2
• Calculated formula: C15 H13 Cl2 N O2
• SMILES: N(C(=O)COc1c(Cl)cc(Cl)cc1)Cc1ccccc1
• Title of publication: <i>N</i>-Benzyl-2-(2,4-dichlorophenoxy)acetamide
• Authors of publication: Chen, Ming-Jun; Fu, Yang-Wu; Dong, Wen-Liang; Li, Zhu-Bo; Zuo, Hua
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 10
• Pages of publication: o1968
• a: 4.7447 ± 0.0006 Å
• b: 26.821 ± 0.003 Å
• c: 11.3962 ± 0.0015 Å
• α: 90°
• β: 90.402 ± 0.002°
• γ: 90°
• Cell volume: 1450.2 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0645
• Residual factor for significantly intense reflections: 0.0387
• Weighted residual factors for significantly intense reflections: 0.0918
• Weighted residual factors for all reflections included in the refinement: 0.1034
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes