Information card for entry 2226763

Structure parameters

• Chemical name: 4-Methyl-<i>N</i>-[(<i>E</i>)-4-methyl-1-(4-methylphenylsulfonyl)-1,2- dihydropyridin-2-ylidene]benzenesulfonamide
• Formula: C20 H20 N2 O4 S2
• Calculated formula: C20 H20 N2 O4 S2
• SMILES: N(=C1/C=C(C=CN1S(=O)(=O)c1ccc(cc1)C)C)/S(=O)(=O)c1ccc(cc1)C
• Title of publication: 4-Methyl-<i>N</i>-[(<i>E</i>)-4-methyl-1-(4-methylphenylsulfonyl)-1,2-dihydropyridin-2-ylidene]benzenesulfonamide
• Authors of publication: Tabatabaee, Masoumeh; Ghassemzadeh, Mitra; Hesami, Liela; Neumüller, Bernhard
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 8
• Pages of publication: o1891
• a: 14.888 ± 0.001 Å
• b: 13.884 ± 0.001 Å
• c: 18.843 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3894.9 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0751
• Residual factor for significantly intense reflections: 0.0444
• Weighted residual factors for significantly intense reflections: 0.0863
• Weighted residual factors for all reflections included in the refinement: 0.0942
• Goodness-of-fit parameter for all reflections included in the refinement: 0.939
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes