Information card for entry 2231559

Structure parameters

• Chemical name: <i>N</i>,<i>N</i>'-(Ethane-1,2-diyl)dibenzenesulfonamide
• Formula: C14 H16 N2 O4 S2
• Calculated formula: C14 H16 N2 O4 S2
• SMILES: S(=O)(=O)(NCCNS(=O)(=O)c1ccccc1)c1ccccc1
• Title of publication: <i>N</i>,<i>N</i>'-(Ethane-1,2-diyl)dibenzenesulfonamide
• Authors of publication: Al-Dajani, Mohammad T. M.; Talaat, Jamal; Mohamed, Nornisah; Hemamalini, Madhukar; Fun, Hoong-Kun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 9
• Pages of publication: o2214
• a: 5.2115 ± 0.0004 Å
• b: 16.6905 ± 0.0013 Å
• c: 17.875 ± 0.0014 Å
• α: 90°
• β: 93.187 ± 0.002°
• γ: 90°
• Cell volume: 1552.4 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• 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: 0.0648
• Residual factor for significantly intense reflections: 0.0421
• Weighted residual factors for significantly intense reflections: 0.1049
• Weighted residual factors for all reflections included in the refinement: 0.119
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes