Information card for entry 4343005

Structure parameters

• Formula: C16 H26 Al N O
• Calculated formula: C16 H26 Al N O
• SMILES: [Al]1(Oc2c(cc(cc2C[N]21CCCCC2)C)C)(C)C
• Title of publication: Syntheses of Mononuclear and Dinuclear Aluminum Complexes Stabilized by Phenolato Ligands and Their Applications in the Polymerization of ε-Caprolactone: A Comparative Study.
• Authors of publication: Chen, Lijuan; Li, Wenyi; Yuan, Dan; Zhang, Yong; Shen, Qi; Yao, Yingming
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 10
• Pages of publication: 4699 - 4708
• a: 10.682 ± 0.002 Å
• b: 11.29 ± 0.002 Å
• c: 14.323 ± 0.003 Å
• α: 90°
• β: 107.66 ± 0.03°
• γ: 90°
• Cell volume: 1645.9 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0632
• Residual factor for significantly intense reflections: 0.0563
• Weighted residual factors for significantly intense reflections: 0.1407
• Weighted residual factors for all reflections included in the refinement: 0.145
• Goodness-of-fit parameter for all reflections included in the refinement: 1.155
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No