Information card for entry 2207444

Structure parameters

• Chemical name: (E,E)-4-(4-Nitrophenylethenyl)-1-(2,4,6-trimethoxyphenylethenyl)benzene
• Formula: C25 H23 N O5
• Calculated formula: C25 H23 N O5
• SMILES: O(c1c(c(OC)cc(OC)c1)/C=C/c1ccc(cc1)/C=C/c1ccc(N(=O)=O)cc1)C
• Title of publication: (<i>E</i>,<i>E</i>)-1-[2-(4-Nitrophenyl)ethenyl]-4-[2-(2,4,6-trimethoxyphenyl)ethenyl]benzene
• Authors of publication: Vande Velde, Christophe M. L.; De Borger, Roeland; Blockhuys, Frank
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 12
• Pages of publication: o4289 - o4291
• a: 15.785 ± 0.005 Å
• b: 10.357 ± 0.002 Å
• c: 13.502 ± 0.001 Å
• α: 90°
• β: 105.96 ± 0.02°
• γ: 90°
• Cell volume: 2122.3 ± 0.8 ų
• Cell temperature: 287 ± 2 K
• Ambient diffraction temperature: 287 ± 2 K
• Number of distinct elements: 4
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0977
• Residual factor for significantly intense reflections: 0.0395
• Weighted residual factors for significantly intense reflections: 0.0992
• Weighted residual factors for all reflections included in the refinement: 0.1214
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes