Information card for entry 2236463

Structure parameters

• Chemical name: <i>N</i>-(4-Chlorophenyl)-4-methoxybenzamide
• Formula: C14 H12 Cl N O2
• Calculated formula: C14 H12 Cl N O2
• SMILES: Clc1ccc(NC(=O)c2ccc(OC)cc2)cc1
• Title of publication: <i>N</i>-(4-Chlorophenyl)-4-methoxybenzamide
• Authors of publication: Kant, Rajni; Sahi, Seema; Gupta, Vivek K.; Kapoor, Kamini; Paul, Satya
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 11
• Pages of publication: o3077
• a: 5.4394 ± 0.0002 Å
• b: 7.7754 ± 0.0003 Å
• c: 14.9262 ± 0.0006 Å
• α: 78.759 ± 0.003°
• β: 80.712 ± 0.003°
• γ: 88.821 ± 0.003°
• Cell volume: 611.01 ± 0.04 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.049
• Residual factor for significantly intense reflections: 0.0387
• Weighted residual factors for significantly intense reflections: 0.0929
• Weighted residual factors for all reflections included in the refinement: 0.0998
• 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