Information card for entry 7026206

Structure parameters

• Formula: C20 H42 Al2 N4
• Calculated formula: C20 H42 Al2 N4
• SMILES: [Al]1([N]2=C(N([Al]([N]3=C(N1C(C)(C)C)CCC3)(C)C)C(C)(C)C)CCC2)(C)C
• Title of publication: Heteroleptic iminopyrrolidinates of aluminium.
• Authors of publication: Wasslen, Yamile A.; Kurek, Agnieszka; Johnson, Paul A.; Pigeon, Taylor C.; Monillas, Wesley H.; Yap, Glenn P. A.; Barry, Seán T
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 38
• Pages of publication: 9046 - 9054
• a: 8.168 ± 0.004 Å
• b: 17.903 ± 0.008 Å
• c: 16.396 ± 0.007 Å
• α: 90°
• β: 104.42 ± 0.02°
• γ: 90°
• Cell volume: 2322.1 ± 1.8 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• 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: 0.0559
• Residual factor for significantly intense reflections: 0.0421
• Weighted residual factors for significantly intense reflections: 0.103
• Weighted residual factors for all reflections included in the refinement: 0.1135
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No