Information card for entry 7110203

Structure parameters

• Formula: C21 H29 Al Br N
• Calculated formula: C21 H29 Al Br N
• Title of publication: Imine hydrogenation by alkylaluminum catalysts
• Authors of publication: Jillian A. Hatnean; Jordan W. Thomson; Preston A. Chase; Douglas W. Stephan
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 301
• a: 9.5329 ± 0.001 Å
• b: 11.3713 ± 0.0013 Å
• c: 11.5117 ± 0.0012 Å
• α: 99.77 ± 0.005°
• β: 110.985 ± 0.005°
• γ: 111.068 ± 0.005°
• Cell volume: 1021.5 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0462
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.103
• Weighted residual factors for all reflections included in the refinement: 0.1067
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No