Information card for entry 1545384

Structure parameters

• Chemical name: 2,5-Dimethoxy-<i>N</i>-phenylbenzenesulfonamide
• Formula: C14 H15 N O4 S
• Calculated formula: C14 H15 N O4 S
• SMILES: c1(c(ccc(c1)OC)OC)S(=O)(=O)Nc1ccccc1
• Title of publication: 2,5-Dimethoxy-<i>N</i>-phenylbenzenesulfonamide
• Authors of publication: Shakuntala, K.; Kumari, Vijaya; Lokanath, N. K.; Naveen, S.; Suchetan, P. A.
• Journal of publication: IUCrData
• Year of publication: 2017
• Journal volume: 2
• Journal issue: 2
• Pages of publication: x170311
• a: 10.4328 ± 0.0012 Å
• b: 14.3157 ± 0.0015 Å
• c: 10.4869 ± 0.0012 Å
• α: 90°
• β: 117.064 ± 0.006°
• γ: 90°
• Cell volume: 1394.7 ± 0.3 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: 0.0756
• Residual factor for significantly intense reflections: 0.0666
• Weighted residual factors for significantly intense reflections: 0.1767
• Weighted residual factors for all reflections included in the refinement: 0.1857
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes