Information card for entry 7003951

Structure parameters

• Formula: C22 H30 Al N O
• Calculated formula: C22 H30 Al N O
• SMILES: [Al]1(Oc2c(cccc2C=[N]1c1c(cccc1C(C)C)C(C)C)C)(C)C
• Title of publication: Synthesis of Al complexes containing phenoxy-imine ligands and their use as the catalyst precursors for efficient living ring-opening polymerisation of ε-caprolactone
• Authors of publication: Liu, Jingyu; Iwasa, Naruhito; Nomura, Kotohiro
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 30
• Pages of publication: 3978 - 3988
• a: 34.0799 ± 0.0016 Å
• b: 8.8107 ± 0.0003 Å
• c: 15.1777 ± 0.0006 Å
• α: 90°
• β: 107.793 ± 0.0018°
• γ: 90°
• Cell volume: 4339.4 ± 0.3 ų
• Cell temperature: 243.1 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for all reflections included in the refinement: 0.1333
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No