Information card for entry 2227256

Structure parameters

• Chemical name: <i>N</i>-(5-chloro-2-methoxyphenyl)benzenesulfonamide
• Formula: C13 H12 Cl N O3 S
• Calculated formula: C13 H12 Cl N O3 S
• SMILES: Clc1cc(NS(=O)(=O)c2ccccc2)c(OC)cc1
• Title of publication: <i>N</i>-(5-Chloro-2-methoxyphenyl)benzenesulfonamide
• Authors of publication: Aziz-ur-Rehman; Shahzaman; Akkurt, Mehmet; Abbasi, Muhammad Athar; Khan, Islam Ullah
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 11
• Pages of publication: o2855
• a: 8.2201 ± 0.0002 Å
• b: 8.9395 ± 0.0002 Å
• c: 10.5544 ± 0.0002 Å
• α: 77.206 ± 0.001°
• β: 76.366 ± 0.001°
• γ: 66.408 ± 0.001°
• Cell volume: 683.65 ± 0.03 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: 0.0402
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0911
• Weighted residual factors for all reflections included in the refinement: 0.096
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes