Information card for entry 2228037

Structure parameters

• Common name: 1H-imidazole
• Chemical name: 2-(4-Fluorophenyl)-1,4,5-triphenyl-1<i>H</i>-imidazole
• Formula: C27 H19 F N2
• Calculated formula: C27 H19 F N2
• SMILES: Fc1ccc(c2n(c(c(n2)c2ccccc2)c2ccccc2)c2ccccc2)cc1
• Title of publication: 2-(4-Fluorophenyl)-1,4,5-triphenyl-1<i>H</i>-imidazole
• Authors of publication: Gayathri, P.; Thiruvalluvar, A.; Srinivasan, N.; Jayabharathi, J.; Butcher, R. J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 10
• Pages of publication: o2519
• a: 10.1794 ± 0.0005 Å
• b: 10.5239 ± 0.0006 Å
• c: 10.6175 ± 0.0006 Å
• α: 80.75 ± 0.005°
• β: 85.776 ± 0.004°
• γ: 67.348 ± 0.005°
• Cell volume: 1035.95 ± 0.11 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 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: 0.1297
• Residual factor for significantly intense reflections: 0.0489
• Weighted residual factors for significantly intense reflections: 0.1091
• Weighted residual factors for all reflections included in the refinement: 0.1283
• Goodness-of-fit parameter for all reflections included in the refinement: 0.863
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes