Information card for entry 4066190

Structure parameters

• Formula: C36 H49 Al N2
• Calculated formula: C36 H49 Al N2
• SMILES: [Al]1(c2c(cccc2/C=N/c2c(cccc2C(C)C)C(C)C)C=[N]1c1c(cccc1C(C)C)C(C)C)(CC)CC
• Title of publication: Bis(imino)aryl NCN Pincer Aluminum and Zinc Complexes: Synthesis, Characterization, and Catalysis onl-Lactide Polymerization
• Authors of publication: Liu, Zhizhou; Gao, Wei; Zhang, Jingshun; Cui, Dongmei; Wu, Qiaolin; Mu, Ying
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 22
• Pages of publication: 5783
• a: 17.3438 ± 0.0019 Å
• b: 9.5471 ± 0.0011 Å
• c: 20.73 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3432.5 ± 0.6 ų
• Cell temperature: 185 ± 2 K
• Ambient diffraction temperature: 185 ± 2 K
• Number of distinct elements: 4
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0834
• Residual factor for significantly intense reflections: 0.0488
• Weighted residual factors for significantly intense reflections: 0.1009
• Weighted residual factors for all reflections included in the refinement: 0.1147
• Goodness-of-fit parameter for all reflections included in the refinement: 1.008
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No