Information card for entry 2231346

Structure parameters

• Chemical name: <i>N</i>-(3-Chlorophenyl)-<i>N</i>'-(3-methylphenyl)succinamide
• Formula: C17 H17 Cl N2 O2
• Calculated formula: C17 H17 Cl N2 O2
• SMILES: O=C(Nc1cccc(c1)Cl)CCC(=O)Nc1cccc(c1)C
• Title of publication: <i>N</i>-(3-Chlorophenyl)-<i>N</i>'-(3-methylphenyl)succinamide
• Authors of publication: Saraswathi, B. S.; Foro, Sabine; Gowda, B. Thimme
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 8
• Pages of publication: o2077
• a: 4.84 ± 0.001 Å
• b: 5.56 ± 0.001 Å
• c: 14.752 ± 0.003 Å
• α: 93.47 ± 0.02°
• β: 91.39 ± 0.02°
• γ: 97.71 ± 0.02°
• Cell volume: 392.46 ± 0.14 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: 0.0663
• Residual factor for significantly intense reflections: 0.0495
• Weighted residual factors for significantly intense reflections: 0.1164
• Weighted residual factors for all reflections included in the refinement: 0.1296
• Goodness-of-fit parameter for all reflections included in the refinement: 0.991
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes