Information card for entry 4325695

Structure parameters

• Formula: C150 H145 Al4 B2 Cl18 F48 N4 O18
• Calculated formula: C150 H145 Al4 B2 Cl18 F48 N4 O18
• Title of publication: Ring-Opening Polymerization of Cyclic Esters and Trimethylene Carbonate Catalyzed by Aluminum Half-Salen Complexes
• Authors of publication: Donald J. Darensbourg; Osit Karroonnirun; Stephanie J. Wilson
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 6775 - 6787
• a: 29.458 ± 0.002 Å
• b: 20.3463 ± 0.0015 Å
• c: 30.256 ± 0.002 Å
• α: 90°
• β: 102.383 ± 0.004°
• γ: 90°
• Cell volume: 17712 ± 2 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 8
• 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: 0.2258
• Residual factor for significantly intense reflections: 0.1655
• Weighted residual factors for significantly intense reflections: 0.327
• Weighted residual factors for all reflections included in the refinement: 0.3404
• Goodness-of-fit parameter for all reflections included in the refinement: 3.754
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No