Information card for entry 2236125

Structure parameters

• Chemical name: 2-(3,4-Dimethoxyphenyl)-4,5-diphenyl-1-(prop-2-en-1-yl)-1<i>H</i>-imidazole
• Formula: C26 H24 N2 O2
• Calculated formula: C26 H24 N2 O2
• SMILES: O(c1c(OC)ccc(c1)c1nc(c(n1CC=C)c1ccccc1)c1ccccc1)C
• Title of publication: 2-(3,4-Dimethoxyphenyl)-4,5-diphenyl-1-(prop-2-en-1-yl)-1<i>H</i>-imidazole
• Authors of publication: Mohamed, Shaaban K.; Akkurt, Mehmet; Fronczek, Frank R.; Marzouk, Adel A. E.; Abdelhamid, Antar A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 10
• Pages of publication: o2979 - o2980
• a: 8.9683 ± 0.0004 Å
• b: 10.7916 ± 0.0005 Å
• c: 11.7219 ± 0.0005 Å
• α: 110.174 ± 0.002°
• β: 106.267 ± 0.002°
• γ: 91.991 ± 0.003°
• Cell volume: 1011.32 ± 0.08 ų
• Cell temperature: 90 ± 0.5 K
• Ambient diffraction temperature: 90 ± 0.5 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0752
• Residual factor for significantly intense reflections: 0.0477
• Weighted residual factors for significantly intense reflections: 0.112
• Weighted residual factors for all reflections included in the refinement: 0.1274
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes