Information card for entry 7045689

Structure parameters

• Formula: C36 H45 Al N2 O
• Calculated formula: C36 H45 Al N2 O
• Title of publication: Living ring-opening polymerization of ε-caprolactone catalyzed by β-quinolyl-enamino aluminium complexes: ligand electronic effects.
• Authors of publication: Wang, Peng; Chao, Jianbin; Chen, Xia
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 12
• Pages of publication: 4118 - 4127
• a: 9.6198 ± 0.0004 Å
• b: 9.7898 ± 0.0004 Å
• c: 19.677 ± 0.0009 Å
• α: 91.563 ± 0.002°
• β: 103.797 ± 0.001°
• γ: 116.983 ± 0.001°
• Cell volume: 1583.95 ± 0.12 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.0747
• Residual factor for significantly intense reflections: 0.0555
• Weighted residual factors for significantly intense reflections: 0.1347
• Weighted residual factors for all reflections included in the refinement: 0.1476
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No