Information card for entry 4067685

Structure parameters

• Chemical name: Al(OCH2CH2NH2)Et2
• Formula: C12 H32 Al2 N2 O2
• Calculated formula: C12 H32 Al2 N2 O2
• SMILES: C1C[NH2][Al]2(CC)(CC)[O]1[Al]1(CC)(CC)[NH2]CC[O]21
• Title of publication: Sulfonamide-Supported Aluminum Catalysts for the Ring-Opening Polymerization ofrac-Lactide
• Authors of publication: Schwarz, Andrew D.; Chu, Zengyong; Mountford, Philip
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 5
• Pages of publication: 1246
• a: 6.5609 ± 0.0001 Å
• b: 9.9473 ± 0.0002 Å
• c: 13.1716 ± 0.0003 Å
• α: 90°
• β: 95.2425 ± 0.0008°
• γ: 90°
• Cell volume: 856.03 ± 0.03 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0494
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for all reflections: 0.0508
• Weighted residual factors for significantly intense reflections: 0.0405
• Weighted residual factors for all reflections included in the refinement: 0.0394
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0928
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No