Information card for entry 4083015

Structure parameters

• Formula: C25 H60 Al4 N4
• Calculated formula: C25 H60 Al4 N4
• SMILES: [Al]1([N]([Al](C)(C)C)(CCC[N]2([Al]([N](=C2C)C(C)(C)C)(C)C)[Al](C)(C)C)C(=[N]1C(C)(C)C)C)(C)C
• Title of publication: Syntheses and Structures of Bis-Amidinate‒Alane Complexes
• Authors of publication: Bayram, Melike; Bläser, Dieter; Wölper, Christoph; Schulz, Stephan
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 8
• Pages of publication: 2080
• a: 14.413 ± 0.003 Å
• b: 16.861 ± 0.003 Å
• c: 29.284 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7117 ± 2 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0838
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for significantly intense reflections: 0.1027
• Weighted residual factors for all reflections included in the refinement: 0.1216
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No