Information card for entry 2231375

Structure parameters

• Chemical name: <i>N</i>,<i>N</i>'-Bis(4-chlorophenylsulfonyl)adipamide
• Formula: C18 H18 Cl2 N2 O6 S2
• Calculated formula: C18 H18 Cl2 N2 O6 S2
• SMILES: O=C(NS(=O)(=O)c1ccc(cc1)Cl)CCCCC(=O)NS(=O)(=O)c1ccc(cc1)Cl
• Title of publication: <i>N</i>,<i>N</i>'-Bis(4-chlorophenylsulfonyl)adipamide
• Authors of publication: Rodrigues, Vinola Z.; 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: o2179
• a: 5.593 ± 0.001 Å
• b: 8.827 ± 0.002 Å
• c: 9.908 ± 0.002 Å
• α: 89.28 ± 0.02°
• β: 87.75 ± 0.02°
• γ: 81.16 ± 0.01°
• Cell volume: 482.96 ± 0.17 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2128
• Residual factor for significantly intense reflections: 0.0806
• Weighted residual factors for significantly intense reflections: 0.0723
• Weighted residual factors for all reflections included in the refinement: 0.1035
• Goodness-of-fit parameter for all reflections included in the refinement: 0.993
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes