Information card for entry 2238793

Structure parameters

• Chemical name: 4-Methoxy-<i>N</i>-[(4-methylphenyl)sulfonyl]benzamide
• Formula: C15 H15 N O4 S
• Calculated formula: C15 H15 N O4 S
• Title of publication: 4-Methoxy-<i>N</i>-[(4-methylphenyl)sulfonyl]benzamide including an unknown solvate
• Authors of publication: Sreenivasa, Swamy; Palakshamurthy, Bandrehalli Siddagangaiah; Tonannavar, Jagdish; Jayashree, Yenagi; Sudha, Achar Gurumurthy; Suchetan, Parameshwar Adimoole
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 11
• Pages of publication: o1664 - o1665
• a: 27.1686 ± 0.0016 Å
• b: 27.1686 ± 0.0016 Å
• c: 10.8594 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 6941.8 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0527
• Residual factor for significantly intense reflections: 0.0393
• Weighted residual factors for significantly intense reflections: 0.1032
• Weighted residual factors for all reflections included in the refinement: 0.1089
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No