Information card for entry 4020541

Structure parameters

• Common name: (S)-2-anisyl(t-butyl)methylphosphpine-borane
• Formula: C12 H22 B O P
• Calculated formula: C12 H22 B O P
• SMILES: [P](C)([BH3])(c1c(cccc1)OC)C(C)(C)C
• Title of publication: P-Chiral o-Phosphinophenol as a P/O Hybrid Ligand: Preparation and Use in Cu-Catalyzed Asymmetric Conjugate Addition of Diethylzinc to Acyclic Enones
• Authors of publication: Yukitoshi Takahashi; Yoshikazu Yamamoto; Kosuke Katagiri; Hiroshi Danjo; Kentaro Yamaguchi; Tsuneo Imamoto
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 9009 - 9012
• a: 9.365 ± 0.0002 Å
• b: 10.6994 ± 0.0002 Å
• c: 13.7621 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1378.96 ± 0.04 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No