Information card for entry 4322323

Structure parameters

• Chemical name: Tetra-(3,5-dimethylpyridin)Lithium-tetrakis(N-dihydro-3,5- dimethylpyridyl)-aluminate
• Formula: C56 H76 Al Li N8
• Calculated formula: C56 H76 Al Li N8
• SMILES: [Al]([n]1cc(cc(c1)C)C)([n]1cc(cc(c1)C)C)([n]1cc(cc(c1)C)C)[n]1cc(cc(c1)C)C.c1c(C)cc(C)c[n]1[Li]([n]1cc(C)cc(C)c1)([n]1cc(C)cc(C)c1)[n]1cc(C)cc(C)c1
• Title of publication: Synthesis and Structural Characterization of (1,4-Dihydropyrid-1-yl)aluminum Complexes
• Authors of publication: Karl Hensen; Alexander Lemke; Thorsten Stumpf; Michael Bolte; Holger Fleischer; Colin R. Pulham; Robert O. Gould; Steven Harris
• Journal of publication: Inorganic Chemistry
• Year of publication: 1999
• Journal volume: 38
• Pages of publication: 4700 - 4704
• a: 14.0323 ± 0.0003 Å
• b: 11.9759 ± 0.0002 Å
• c: 16.8104 ± 0.0002 Å
• α: 90°
• β: 107.682 ± 0.001°
• γ: 90°
• Cell volume: 2691.52 ± 0.08 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.1245
• Residual factor for significantly intense reflections: 0.0714
• Weighted residual factors for all reflections: 0.1553
• Weighted residual factors for significantly intense reflections: 0.1335
• Weighted residual factors for all reflections included in the refinement: 0.1553
• Goodness-of-fit parameter for all reflections: 1.074
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No