Information card for entry 7020312

Structure parameters

• Formula: C49 H52 Al N O
• Calculated formula: C49 H52 Al N O
• SMILES: [Al]1([N](c2c(cc(cc2C(c2ccccc2)c2ccccc2)C(C)C)C(c2ccccc2)c2ccccc2)=Cc2c(O1)c(cc(c2)C)C(C)(C)C)(C)C
• Title of publication: Dimethylaluminium aldiminophenolates: synthesis, characterization and ring-opening polymerization behavior towards lactides.
• Authors of publication: Zhang, Wenjuan; Wang, Youhong; Sun, Wen-Hua; Wang, Lin; Redshaw, Carl
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 38
• Pages of publication: 11587 - 11596
• a: 12.114 ± 0.002 Å
• b: 15.129 ± 0.003 Å
• c: 23.294 ± 0.005 Å
• α: 90°
• β: 99.69 ± 0.03°
• γ: 90°
• Cell volume: 4208.2 ± 1.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0976
• Residual factor for significantly intense reflections: 0.0844
• Weighted residual factors for significantly intense reflections: 0.1978
• Weighted residual factors for all reflections included in the refinement: 0.2118
• Goodness-of-fit parameter for all reflections included in the refinement: 1.236
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No