Information card for entry 2228217

Structure parameters

• Chemical name: <i>N</i>-(2,6-Dichlorophenyl)benzenesulfonamide
• Formula: C12 H9 Cl2 N O2 S
• Calculated formula: C12 H9 Cl2 N O2 S
• SMILES: c1(ccccc1)S(=O)(=O)Nc1c(cccc1Cl)Cl
• Title of publication: <i>N</i>-(2,6-Dichlorophenyl)benzenesulfonamide
• Authors of publication: Nirmala, P. G.; Foro, Sabine; Gowda, B. Thimme; Fuess, Hartmut
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 12
• Pages of publication: o3061
• a: 5.059 ± 0.001 Å
• b: 17.143 ± 0.004 Å
• c: 15.351 ± 0.003 Å
• α: 90°
• β: 90.43 ± 0.02°
• γ: 90°
• Cell volume: 1331.3 ± 0.5 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0824
• Residual factor for significantly intense reflections: 0.0399
• Weighted residual factors for significantly intense reflections: 0.0808
• Weighted residual factors for all reflections included in the refinement: 0.0884
• Goodness-of-fit parameter for all reflections included in the refinement: 0.853
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes