Information card for entry 2233292

Structure parameters

• Chemical name: 2,2',5,5'-Tetrachloro-<i>N</i>,<i>N</i>'-diethyl-<i>N</i>,<i>N</i>'- [benzene-1,3-diylbis(methylene)]dibenzenesulfonamide
• Formula: C24 H24 Cl4 N2 O4 S2
• Calculated formula: C24 H24 Cl4 N2 O4 S2
• SMILES: c1c(cccc1CN(CC)S(=O)(=O)c1c(ccc(c1)Cl)Cl)CN(CC)S(=O)(=O)c1c(ccc(c1)Cl)Cl
• Title of publication: 2,2',5,5'-Tetrachloro-<i>N</i>,<i>N</i>'-diethyl-<i>N</i>,<i>N</i>'-[benzene-1,3-diylbis(methylene)]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: 2012
• Journal volume: 68
• Journal issue: 1
• Pages of publication: o15
• a: 8.0396 ± 0.0002 Å
• b: 11.1512 ± 0.0003 Å
• c: 15.5723 ± 0.0003 Å
• α: 87.454 ± 0.001°
• β: 83.378 ± 0.001°
• γ: 87.995 ± 0.001°
• Cell volume: 1384.76 ± 0.06 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0495
• Residual factor for significantly intense reflections: 0.0358
• Weighted residual factors for significantly intense reflections: 0.0914
• Weighted residual factors for all reflections included in the refinement: 0.1017
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes