Information card for entry 4105218

Structure parameters

• Formula: C24 H23 Br N2 O P
• Calculated formula: C24 H23 Br N2 O P
• SMILES: Brc1ccc(cc1)C(C#N)NP(=O)(c1c(cccc1C)C)c1c(cccc1C)C
• Title of publication: Dual-Activation Asymmetric Strecker Reaction of Aldimines and Ketimines Catalyzed by a Tethered Bis(8-quinolinolato) Aluminum Complex
• Authors of publication: Joshua P. Abell; Hisashi Yamamoto
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 15118 - 15119
• a: 11.022 ± 0.007 Å
• b: 18.809 ± 0.013 Å
• c: 11.102 ± 0.008 Å
• α: 90°
• β: 109.586 ± 0.011°
• γ: 90°
• Cell volume: 2168 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0949
• Residual factor for significantly intense reflections: 0.0723
• Weighted residual factors for significantly intense reflections: 0.1349
• Weighted residual factors for all reflections included in the refinement: 0.1408
• Goodness-of-fit parameter for all reflections included in the refinement: 1.165
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No