Information card for entry 7055991

Structure parameters

• Formula: C70 H108 Al2 Cl6 N4 O4
• Calculated formula: C70 H108 Al2 Cl6 N4 O4
• Title of publication: Synthesis of dinuclear aluminum complexes bearing bis-phenolate ligand and application in ring-opening polymerization of ε-caprolactone
• Authors of publication: Zhang, Jie; Liu, Shaofeng; Zuo, Weiwei; Ye, Hongqi; Li, Zhibo
• Journal of publication: New J. Chem.
• Year of publication: 2017
• Journal volume: 41
• Journal issue: 6
• Pages of publication: 2358
• a: 10.6582 ± 0.0012 Å
• b: 11.7546 ± 0.0012 Å
• c: 15.703 ± 0.0018 Å
• α: 86.775 ± 0.004°
• β: 82.638 ± 0.003°
• γ: 84.317 ± 0.005°
• Cell volume: 1939.6 ± 0.4 ų
• Cell temperature: 173.15 K
• Ambient diffraction temperature: 173.15 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0729
• Residual factor for significantly intense reflections: 0.0692
• Weighted residual factors for significantly intense reflections: 0.1865
• Weighted residual factors for all reflections included in the refinement: 0.19
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No