Information card for entry 7013384

Structure parameters

• Formula: C40.5 H56.5 Al N2 O2
• Calculated formula: C40.5 H56.5 Al N2 O2
• Title of publication: Aluminium metal complexes supported by amine bis-phenolate ligands as catalysts for ring-opening polymerization of ?-caprolactone
• Authors of publication: Chen, Chi-Tien; Huang, Chi-An; Huang, Bor-Hunn
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 19
• Pages of publication: 3799
• a: 15.7989 ± 0.001 Å
• b: 15.3016 ± 0.001 Å
• c: 17.3809 ± 0.0011 Å
• α: 90°
• β: 109.853 ± 0.001°
• γ: 90°
• Cell volume: 3952.1 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0826
• Residual factor for significantly intense reflections: 0.0571
• Weighted residual factors for significantly intense reflections: 0.1737
• Weighted residual factors for all reflections included in the refinement: 0.191
• Goodness-of-fit parameter for all reflections included in the refinement: 1.252
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No