Information card for entry 2227739

Structure parameters

• Chemical name: 3-(1,2-Diphenylethenyl)-2-phenyl-1<i>H</i>-indole
• Formula: C28 H21 N
• Calculated formula: C28 H21 N
• SMILES: c1(c(c2ccccc2[nH]1)/C(=C\c1ccccc1)c1ccccc1)c1ccccc1
• Title of publication: 3-(1,2-Diphenylethenyl)-2-phenyl-1<i>H</i>-indole
• Authors of publication: Mahaboob, P. A. Abdullah; NizamMohideen, M.; Bhaskar, G.; Perumal, P. T.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 11
• Pages of publication: o2745
• a: 11.4227 ± 0.0006 Å
• b: 8.6998 ± 0.0005 Å
• c: 20.6203 ± 0.0013 Å
• α: 90°
• β: 94.413 ± 0.004°
• γ: 90°
• Cell volume: 2043.1 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.2148
• Residual factor for significantly intense reflections: 0.0704
• Weighted residual factors for significantly intense reflections: 0.1647
• Weighted residual factors for all reflections included in the refinement: 0.2209
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes