Information card for entry 2241490

Structure parameters

• Chemical name: Methyl (2<i>Z</i>)-2-{[<i>N</i>-(2-formylphenyl)-4-methylbenzenesulfonamido]methyl}-3-(4-methoxyphenyl)prop-2-enoate
• Formula: C26 H25 N O6 S
• Calculated formula: C26 H25 N O6 S
• Title of publication: Crystal structure of methyl (2<i>Z</i>)-2-{[<i>N</i>-(2-formylphenyl)-4-methylbenzenesulfonamido]methyl}-3-(4-methoxyphenyl)prop-2-enoate
• Authors of publication: Trigunait, Ankur; Damodharan, Kannan; Manickam, Bakthadoss; Krishnasamy, Gunasekaran
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 12
• Pages of publication: o1088 - o1089
• a: 8.3501 ± 0.0002 Å
• b: 8.4859 ± 0.0002 Å
• c: 17.6814 ± 0.0004 Å
• α: 84.424 ± 0.001°
• β: 80.952 ± 0.001°
• γ: 80.954 ± 0.001°
• Cell volume: 1218.52 ± 0.05 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.061
• Residual factor for significantly intense reflections: 0.0441
• Weighted residual factors for significantly intense reflections: 0.1227
• Weighted residual factors for all reflections included in the refinement: 0.1349
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes