Information card for entry 4083016

Structure parameters

• Formula: C26 H62 Al4 N4
• Calculated formula: C26 H62 Al4 N4
• SMILES: C(C[N]1(C(=[N](C(C)(C)C)[Al]1(C)C)C)[Al](C)(C)C)CC[N]1(C(=[N](C(C)(C)C)[Al]1(C)C)C)[Al](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: 9.542 ± 0.0004 Å
• b: 14.843 ± 0.0006 Å
• c: 13.2769 ± 0.0005 Å
• α: 90°
• β: 102.365 ± 0.002°
• γ: 90°
• Cell volume: 1836.81 ± 0.13 ų
• Cell temperature: 180 ± 1 K
• Ambient diffraction temperature: 180 ± 1 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0493
• Residual factor for significantly intense reflections: 0.0387
• Weighted residual factors for significantly intense reflections: 0.1074
• Weighted residual factors for all reflections included in the refinement: 0.1166
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No