Information card for entry 2232953

Structure parameters

• Chemical name: <i>N</i>,<i>N</i>'-Bis(3-methylbut-2-enyl)-<i>N</i>,<i>N</i>'-(1,4- phenylene)dibenzenesulfonamide
• Formula: C28 H32 N2 O4 S2
• Calculated formula: C28 H32 N2 O4 S2
• SMILES: CC(=CCN(S(=O)(=O)c1ccccc1)c1ccc(cc1)N(S(=O)(=O)c1ccccc1)CC=C(C)C)C
• Title of publication: <i>N</i>,<i>N</i>'-Bis(3-methylbut-2-enyl)-<i>N</i>,<i>N</i>'-(1,4-phenylene)dibenzenesulfonamide
• Authors of publication: Ejaz; Khan, Islam Ullah; Sheikh, Tahir Ali; Harrison, William T. A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 12
• Pages of publication: o3281
• a: 10.6574 ± 0.0004 Å
• b: 20.8073 ± 0.0008 Å
• c: 6.4015 ± 0.0002 Å
• α: 90°
• β: 105.673 ± 0.002°
• γ: 90°
• Cell volume: 1366.76 ± 0.09 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: 0.0612
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.0935
• Weighted residual factors for all reflections included in the refinement: 0.1044
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes