Information card for entry 2220283

Structure parameters

• Formula: C14 H17 Cl2 N O2
• Calculated formula: C14 H17 Cl2 N O2
• SMILES: Clc1c(OCC(=O)NC2CCCCC2)cccc1Cl
• Title of publication: <i>N</i>-Cyclohexyl-2-(2,3-dichlorophenoxy)acetamide
• Authors of publication: Zuo, Hua; Li, Zhu-Bo; Dong, Wen-Liang; Wang, Li-Ying
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 12
• Pages of publication: o2288
• a: 14.075 ± 0.003 Å
• b: 11.17 ± 0.002 Å
• c: 9.622 ± 0.002 Å
• α: 90°
• β: 102.945 ± 0.004°
• γ: 90°
• Cell volume: 1474.3 ± 0.5 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 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: 0.0698
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.1072
• Weighted residual factors for all reflections included in the refinement: 0.1243
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes