Information card for entry 2209343

Structure parameters

• Chemical name: N-(2,3-Dichlorophenyl)benzenesulfonamide
• Formula: C12 H9 Cl2 N O2 S
• Calculated formula: C12 H9 Cl2 N O2 S
• SMILES: S(=O)(=O)(Nc1c(Cl)c(Cl)ccc1)c1ccccc1
• Title of publication: <i>N</i>-(2,3-Dichlorophenyl)benzenesulfonamide
• Authors of publication: Tkachev, Valery V.; Schaper, Klaus-Jürgen; Strakhova, Nadezda N.; Kazachenko, Vladimir P.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 6
• Pages of publication: o2514 - o2515
• a: 8.466 ± 0.001 Å
• b: 9.805 ± 0.001 Å
• c: 15.876 ± 0.002 Å
• α: 90°
• β: 92.1 ± 0.01°
• γ: 90°
• Cell volume: 1317 ± 0.3 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1108
• Residual factor for significantly intense reflections: 0.0485
• Weighted residual factors for significantly intense reflections: 0.0854
• Weighted residual factors for all reflections included in the refinement: 0.1033
• Goodness-of-fit parameter for all reflections included in the refinement: 0.998
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes