Information card for entry 2233616

Structure parameters

• Chemical name: 2-(4,5-Diphenyl-2-<i>p</i>-tolyl-1<i>H</i>-imidazol-1-yl)-3-phenylpropan-1-ol
• Formula: C31 H28 N2 O
• Calculated formula: C31 H28 N2 O
• SMILES: OC[C@@H](n1c(c(nc1c1ccc(cc1)C)c1ccccc1)c1ccccc1)Cc1ccccc1
• Title of publication: 2-(4,5-Diphenyl-2-<i>p</i>-tolyl-1<i>H</i>-imidazol-1-yl)-3-phenylpropan-1-ol
• Authors of publication: Xiao, Yongmei; Yang, Liangru; He, Kun; Yuan, Jinwei; Mao, Pu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 2
• Pages of publication: o264
• a: 9.3413 ± 0.0007 Å
• b: 13.7402 ± 0.0011 Å
• c: 19.6296 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2519.5 ± 0.3 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291.15 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.042
• Residual factor for significantly intense reflections: 0.0367
• Weighted residual factors for significantly intense reflections: 0.0934
• Weighted residual factors for all reflections included in the refinement: 0.0978
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes