Information card for entry 2220437

Structure parameters

• Chemical name: 4,4'-Dichloro-<i>N</i>,<i>N</i>'-(<i>o</i>-phenylene)dibenzenesulfonamide
• Formula: C18 H14 Cl2 N2 O4 S2
• Calculated formula: C18 H14 Cl2 N2 O4 S2
• SMILES: c1(c(cccc1)NS(=O)(=O)c1ccc(cc1)Cl)NS(=O)(=O)c1ccc(cc1)Cl
• Title of publication: 4,4'-Dichloro-<i>N</i>,<i>N</i>'-(<i>o</i>-phenylene)dibenzenesulfonamide
• Authors of publication: Krainova, Julia; Dares, Christopher; Lever, A. B. P.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 1
• Pages of publication: o178
• a: 7.7225 ± 0.0004 Å
• b: 11.192 ± 0.0004 Å
• c: 11.9325 ± 0.0005 Å
• α: 109.669 ± 0.002°
• β: 91.42 ± 0.002°
• γ: 101.782 ± 0.002°
• Cell volume: 945.79 ± 0.07 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 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: 0.0616
• Residual factor for significantly intense reflections: 0.0459
• Weighted residual factors for significantly intense reflections: 0.111
• Weighted residual factors for all reflections included in the refinement: 0.1221
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes