Information card for entry 2203978

Structure parameters

• Common name: N-cyclohexyl-4-methoxycarbonylbenzamide
• Chemical name: methyl 4-(cyclohexylaminocarbonyl)benzoate
• Formula: C15 H19 N O3
• Calculated formula: C15 H19 N O3
• SMILES: c1(ccc(cc1)C(=O)OC)C(=O)NC1CCCCC1
• Title of publication: <i>N</i>-Cyclohexyl-4-(methoxycarbonyl)benzamide
• Authors of publication: Jones, Peter G.; Kuś, Piotr
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 8
• Pages of publication: o1299 - o1300
• a: 10.107 ± 0.002 Å
• b: 11.957 ± 0.002 Å
• c: 12.836 ± 0.002 Å
• α: 64.832 ± 0.005°
• β: 78.988 ± 0.005°
• γ: 72.857 ± 0.005°
• Cell volume: 1337.7 ± 0.4 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0931
• Residual factor for significantly intense reflections: 0.0653
• Weighted residual factors for significantly intense reflections: 0.1578
• Weighted residual factors for all reflections included in the refinement: 0.1698
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes