Information card for entry 2230564

Structure parameters

• Chemical name: (<i>S</i>)-2-(1-Methylindolin-2-yl)-1,3-diphenylpropan-2-ol
• Formula: C24 H25 N O
• Calculated formula: C24 H25 N O
• SMILES: OC(Cc1ccccc1)(Cc1ccccc1)[C@H]1N(c2c(C1)cccc2)C
• Title of publication: (<i>S</i>)-2-(1-Methylindolin-2-yl)-1,3-diphenylpropan-2-ol
• Authors of publication: Lin, Ning; Chen, Miao-Miao; Deng, Yan-Qiu; Luo, Ren-Shi; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 6
• Pages of publication: o1515
• a: 9.8501 ± 0.0006 Å
• b: 12.088 ± 0.0007 Å
• c: 15.4883 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1844.2 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0496
• Residual factor for significantly intense reflections: 0.0444
• Weighted residual factors for significantly intense reflections: 0.1152
• Weighted residual factors for all reflections included in the refinement: 0.1199
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes