Information card for entry 4514763

Structure parameters

• Formula: C22 H19 O P
• Calculated formula: C22 H19 O P
• SMILES: P(c1ccccc1)(c1ccccc1)[C@@H]1C[C@@H]2O[C@H]1c1c2cccc1
• Title of publication: Asymmetric Hydrophosphination of Heterobicyclic Alkenes: Facile Access to Phosphine Ligands for Asymmetric Catalysis
• Authors of publication: Lu, Zhiwu; Zhang, Haoyang; Yang, Zhiping; Ding, Ning; Meng, Ling; Wang, Jun
• Journal of publication: ACS Catalysis
• Year of publication: 2019
• Journal volume: 9
• Journal issue: 2
• Pages of publication: 1457
• a: 15.7797 ± 0.0004 Å
• b: 6.4246 ± 0.0002 Å
• c: 18.8309 ± 0.0006 Å
• α: 90°
• β: 114.711 ± 0.002°
• γ: 90°
• Cell volume: 1734.23 ± 0.09 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0466
• Residual factor for significantly intense reflections: 0.0452
• Weighted residual factors for significantly intense reflections: 0.1129
• Weighted residual factors for all reflections included in the refinement: 0.1141
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No