Information card for entry 2218142

Structure parameters

• Chemical name: 2,4-Dichloro-N-cyclohexylbenzamide
• Formula: C13 H15 Cl2 N O
• Calculated formula: C13 H15 Cl2 N O
• SMILES: Clc1c(C(=O)NC2CCCCC2)ccc(Cl)c1
• Title of publication: 2,4-Dichloro-<i>N</i>-cyclohexylbenzamide
• Authors of publication: Saeed, Aamer; Abbas, Naeem; Hussain, Shahid; Flörke, Ulrich
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 5
• Pages of publication: o773
• a: 26.135 ± 0.003 Å
• b: 4.9144 ± 0.0006 Å
• c: 20.449 ± 0.002 Å
• α: 90°
• β: 90.167 ± 0.003°
• γ: 90°
• Cell volume: 2626.4 ± 0.5 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0635
• Residual factor for significantly intense reflections: 0.0433
• Weighted residual factors for significantly intense reflections: 0.1008
• Weighted residual factors for all reflections included in the refinement: 0.1102
• 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