Information card for entry 4344885

Structure parameters

• Formula: C25 H47 Al2 N O
• Calculated formula: C25 H47 Al2 N O
• SMILES: [Al]1([O]([Al](C)(C)C)c2c(cc(cc2C[N]21CCCCC2)C(C)(C)C)C(C)(C)C)(C)C
• Title of publication: A Comparative Study on Dinuclear and Mononuclear Aluminum Methyl Complexes Bearing Piperidyl-Phenolato Ligands in ROP of Epoxides.
• Authors of publication: Li, Wenyi; Ouyang, Hao; Chen, Lijuan; Yuan, Dan; Zhang, Yong; Yao, Yingming
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 13
• Pages of publication: 6520 - 6524
• a: 10.339 ± 0.004 Å
• b: 16.092 ± 0.005 Å
• c: 16.733 ± 0.006 Å
• α: 90°
• β: 105.212 ± 0.007°
• γ: 90°
• Cell volume: 2686.4 ± 1.6 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 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: 0.1036
• Residual factor for significantly intense reflections: 0.0694
• Weighted residual factors for significantly intense reflections: 0.1709
• Weighted residual factors for all reflections included in the refinement: 0.2115
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No