Information card for entry 4077611

Structure parameters

• Formula: C28 H68 Al2 Li3 N7
• Calculated formula: C28 H63 Al2 Li3 N7
• SMILES: [Al]123[N]4([Al]5(N([Li]4N1C(C)(C)C)C(C)(C)C)N([Li]1N([Li](N2C(C)(C)C)[N]351C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C
• Title of publication: Entrapment oftert-Butyllithium and Lithiumtert-Butylamide Monomers by Partially Lithiated Derivatives of Aluminum and Gallium Primary Amide Complexes
• Authors of publication: Brask, Justin K.; Chivers, Tristram; Schatte, Gabriele; Yap, Glenn P. A.
• Journal of publication: Organometallics
• Year of publication: 2000
• Journal volume: 19
• Journal issue: 26
• Pages of publication: 5683
• a: 18.929 ± 0.007 Å
• b: 10.966 ± 0.004 Å
• c: 18.59 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3859 ± 2 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 5
• 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: 0.0828
• Residual factor for significantly intense reflections: 0.0688
• Weighted residual factors for significantly intense reflections: 0.1854
• Weighted residual factors for all reflections included in the refinement: 0.1907
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No