Information card for entry 4083481

Structure parameters

• Formula: C18 H44 Al2 N2 O4
• Calculated formula: C18 H44 Al2 N2 O4
• SMILES: [Al]12([O](C(C)(C)C[NH]1CCOC)[Al]1([O]2C(C)(C)C[NH]1CCOC)(C)C)(C)C
• Title of publication: Dinuclear Aluminum Complexes as Catalysts for Cycloaddition of CO2to Epoxides
• Authors of publication: Kim, So Han; Ahn, Duseong; Go, Min Jeong; Park, Myung Hwan; Kim, Min; Lee, Junseong; Kim, Youngjo
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 11
• Pages of publication: 2770
• a: 9.613 ± 0.003 Å
• b: 11.831 ± 0.004 Å
• c: 12.929 ± 0.004 Å
• α: 63.527 ± 0.019°
• β: 84.114 ± 0.019°
• γ: 74.61 ± 0.02°
• Cell volume: 1268.8 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0901
• Residual factor for significantly intense reflections: 0.0483
• Weighted residual factors for significantly intense reflections: 0.1163
• Weighted residual factors for all reflections included in the refinement: 0.1349
• Goodness-of-fit parameter for all reflections included in the refinement: 1.008
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No