Information card for entry 7712759

Structure parameters

• Formula: C17 H29 Al N2
• Calculated formula: C17 H29 Al N2
• SMILES: [AlH2](=C1N(C(=C(N1C)C)C)C)C1(C(=C(C(=C1C)C)C)C)C
• Title of publication: Subvalent Group 13 Molecules by Carbene-induced Hydrogen Abstraction
• Authors of publication: Werner, Luis; Hock, Andreas; Luz, Christian; Riethmann, Melanie; Radius, Udo
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 11.1648 ± 0.001 Å
• b: 15.7523 ± 0.0016 Å
• c: 20.039 ± 0.0016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3524.3 ± 0.6 ų
• Cell temperature: 100 ± 10 K
• Ambient diffraction temperature: 100 ± 10 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: 0.0569
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for significantly intense reflections: 0.1071
• Weighted residual factors for all reflections included in the refinement: 0.1162
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No