Information card for entry 4081344

Structure parameters

• Formula: C30 H48 Al2 N2 O2
• Calculated formula: C30 H48 Al2 N2 O2
• Title of publication: Reactions of an Al‒P-Based Frustrated Lewis Pair with Carbonyl Compounds: Dynamic Coordination of Benzaldehyde, Activation of Benzoyl Chloride, and Al‒C Bond Cleavage with Benzamide
• Authors of publication: Uhl, Werner; Appelt, Christian
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 18
• Pages of publication: 5008
• a: 8.1728 ± 0.0004 Å
• b: 16.6678 ± 0.0007 Å
• c: 11.8972 ± 0.0006 Å
• α: 90°
• β: 104.829 ± 0.003°
• γ: 90°
• Cell volume: 1566.69 ± 0.13 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• 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: 0.0531
• Residual factor for significantly intense reflections: 0.0442
• Weighted residual factors for significantly intense reflections: 0.1224
• Weighted residual factors for all reflections included in the refinement: 0.1277
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No