Information card for entry 4318943

Structure parameters

• Formula: C21 H34 Al N O
• Calculated formula: C21 H34 Al N O
• SMILES: [Al]1([N](=C(C=C(O1)C)C)c1c(cccc1C(C)C)C(C)C)(CC)CC
• Title of publication: Four- and Five-Coordinate Aluminum Ketiminate Complexes: Synthesis, Characterization, and Ring-Opening Polymerization
• Authors of publication: Yu, Ru-Ching; Hung, Chen-Hsiung; Huang, Jui-Hsien; Lee, Horng-Yi; Chen, Jwu-Ting
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Journal issue: 24
• Pages of publication: 6450 - 6455
• a: 10.188 ± 0.005 Å
• b: 20.722 ± 0.01 Å
• c: 10.4 ± 0.005 Å
• α: 90°
• β: 95.002 ± 0.009°
• γ: 90°
• Cell volume: 2187.2 ± 1.8 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1532
• Residual factor for significantly intense reflections: 0.0589
• Weighted residual factors for significantly intense reflections: 0.1147
• Weighted residual factors for all reflections included in the refinement: 0.1371
• Goodness-of-fit parameter for all reflections included in the refinement: 0.711
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No