Information card for entry 2229858

Structure parameters

• Common name: <i>N</i>,<i>N</i>'-Bis(2-chlorophenylsulfonyl)suberamide
• Chemical name: <i>N</i>,<i>N</i>'-Bis(2-chlorophenylsulfonyl)octanediamide
• Formula: C20 H22 Cl2 N2 O6 S2
• Calculated formula: C20 H22 Cl2 N2 O6 S2
• SMILES: O=C(NS(=O)(=O)c1ccccc1Cl)CCCCCCC(=O)NS(=O)(=O)c1ccccc1Cl
• Title of publication: <i>N</i>,<i>N</i>'-Bis(2-chlorophenylsulfonyl)suberamide
• 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: 4
• Pages of publication: o884
• a: 7.8737 ± 0.0009 Å
• b: 9.717 ± 0.001 Å
• c: 14.616 ± 0.002 Å
• α: 90°
• β: 94.575 ± 0.009°
• γ: 90°
• Cell volume: 1114.7 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0547
• Residual factor for significantly intense reflections: 0.0377
• Weighted residual factors for significantly intense reflections: 0.0971
• Weighted residual factors for all reflections included in the refinement: 0.1043
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes