Information card for entry 1505121

Structure parameters

• Formula: C22 H23 Al Cl4 N2 O3
• Calculated formula: C22 H23 Al Cl4 N2 O3
• SMILES: [Al]123([N](=Cc4c(c(cc(c4)Cl)Cl)O2)CC(C[N]1=Cc1c(c(cc(c1)Cl)Cl)O3)(C)C)OC(C)C
• Title of publication: Polymerization ofrac-Lactide Using Schiff Base Aluminum Catalysts: Structure, Activity, and Stereoselectivity
• Authors of publication: Du, Hongzhi; Pang, Xuan; Yu, Haiyang; Zhuang, Xiuli; Chen, Xuesi; Cui, Dongmei; Wang, Xianhong; Jing, Xiabin
• Journal of publication: Macromolecules
• Year of publication: 2007
• Journal volume: 40
• Journal issue: 6
• Pages of publication: 1904
• a: 13.7448 ± 0.0018 Å
• b: 17.259 ± 0.002 Å
• c: 21.561 ± 0.003 Å
• α: 90°
• β: 107.278 ± 0.002°
• γ: 90°
• Cell volume: 4883.9 ± 1.1 ų
• Cell temperature: 187 ± 2 K
• Ambient diffraction temperature: 187 ± 2 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0846
• Residual factor for significantly intense reflections: 0.0709
• Weighted residual factors for significantly intense reflections: 0.1676
• Weighted residual factors for all reflections included in the refinement: 0.1816
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No