Information card for entry 7228756

Structure parameters

• Formula: C20 H26 N O4 P
• Calculated formula: C20 H26 N O4 P
• SMILES: P(=O)(OCC)(OCC)[C@H](c1ccccc1)CC(=O)NCc1ccccc1
• Title of publication: An efficient asymmetric hydrophosphonylation of unsaturated amides catalyzed by rare-earth metal amides [(Me3Si)2N]3RE(μ-Cl)Li(THF)3 with phenoxy-functionalized chiral prolinols
• Authors of publication: Fei, Zenghui; Zeng, Chao; Lu, Chengrong; Zhao, Bei; Yao, Yingming
• Journal of publication: RSC Adv.
• Year of publication: 2017
• Journal volume: 7
• Journal issue: 31
• Pages of publication: 19306
• a: 9.6958 ± 0.0008 Å
• b: 10.0818 ± 0.0009 Å
• c: 21.4683 ± 0.0019 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2098.6 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.1537
• Residual factor for significantly intense reflections: 0.0599
• Weighted residual factors for significantly intense reflections: 0.1074
• Weighted residual factors for all reflections included in the refinement: 0.1356
• Goodness-of-fit parameter for all reflections included in the refinement: 0.915
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No