Information card for entry 4105991

Structure parameters

• Formula: C14 H25 B N O P
• Calculated formula: C14 H25 B N O P
• SMILES: [BH3][P@@](C(C)(C)C)(C)N[C@@H]1[C@@H](Cc2c1cccc2)O
• Title of publication: Stereoselective Synthesis of P-Stereogenic Aminophosphines: Ring Opening of Bulky Oxazaphospholidines
• Authors of publication: Thierry León; Antoni Riera; Xavier Verdaguer
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 5740 - 5743
• a: 12.7622 ± 0.0004 Å
• b: 12.7622 ± 0.0004 Å
• c: 33.2409 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 4688.7 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 154
• Hermann-Mauguin space group symbol: P 32 2 1
• Hall space group symbol: P 32 2"
• Residual factor for all reflections: 0.0564
• Residual factor for significantly intense reflections: 0.0455
• Weighted residual factors for significantly intense reflections: 0.1077
• Weighted residual factors for all reflections included in the refinement: 0.114
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No