Information card for entry 7028815

Structure parameters

• Formula: C19 H15 Al F5 N O
• Calculated formula: C19 H15 Al F5 N O
• SMILES: [Al]1([N](c2c(F)c(F)c(F)c(F)c2F)=CC2=C(O1)c1ccccc1CC2)(C)C
• Title of publication: Living ring-opening homo- and copolymerisation of ε-caprolactone and L-lactide by cyclic β-ketiminato aluminium complexes.
• Authors of publication: Liu, Yan; Dong, Wei-Shi; Liu, Jing-Yu; Li, Yue-Sheng
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 5
• Pages of publication: 2244 - 2251
• a: 7.9649 ± 0.0007 Å
• b: 15.0918 ± 0.0013 Å
• c: 15.0663 ± 0.0013 Å
• α: 90°
• β: 102.838 ± 0.002°
• γ: 90°
• Cell volume: 1765.8 ± 0.3 ų
• Cell temperature: 185 ± 2 K
• Ambient diffraction temperature: 185 ± 2 K
• Number of distinct elements: 6
• 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: 0.0723
• Residual factor for significantly intense reflections: 0.0446
• Weighted residual factors for significantly intense reflections: 0.0976
• Weighted residual factors for all reflections included in the refinement: 0.1096
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No