Information card for entry 7004766

Structure parameters

• Common name: (3-tert.-Butylamino-2,2-dimethyl-1-propanolato-O,N)- dimethylaluminium-O-trimethylaluminium adduct
• Chemical name: [3-tert.-Butylamino-2,2-dimethyl-1-propanolato-O,N]- dimethylaluminium-O-trimethylaluminium adduct
• Formula: C14 H35 Al2 N O
• Calculated formula: C14 H35 Al2 N O
• SMILES: [Al]1([O](CC(C[NH]1C(C)(C)C)(C)C)[Al](C)(C)C)(C)C
• Title of publication: Organo-aluminium and -gallium complexes with ω-NH-functional alkoxide ligands
• Authors of publication: Willner, Alexander; Hepp, Alexander; Mitzel, Norbert W.
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 47
• Pages of publication: 6832 - 6842
• a: 12.393 ± 0.003 Å
• b: 22.611 ± 0.005 Å
• c: 14.83 ± 0.003 Å
• α: 90°
• β: 112.2 ± 0.03°
• γ: 90°
• Cell volume: 3847.6 ± 1.7 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1675
• Residual factor for significantly intense reflections: 0.1203
• Weighted residual factors for significantly intense reflections: 0.2045
• Weighted residual factors for all reflections included in the refinement: 0.2236
• Goodness-of-fit parameter for all reflections included in the refinement: 1.25
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No