Information card for entry 7023791

Structure parameters

• Formula: C21 H36 Al N3
• Calculated formula: C21 H36 Al N3
• SMILES: [AlH2]12N(C(=CC(=[N]1CC[N]2(C)C)C)C)c1c(cccc1C(C)C)C(C)C
• Title of publication: Preparation and properties of a series of structurally diverse aluminium hydrides supported by β-diketiminate and bis(amide) ligands.
• Authors of publication: Nako, Adi E.; Gates, Sarah J.; White, Andrew J. P.; Crimmin, Mark R.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 42
• Pages of publication: 15199 - 15206
• a: 18.9383 ± 0.0003 Å
• b: 13.30838 ± 0.00015 Å
• c: 18.4372 ± 0.0002 Å
• α: 90°
• β: 110.857 ± 0.0016°
• γ: 90°
• Cell volume: 4342.37 ± 0.11 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 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: 0.062
• Residual factor for significantly intense reflections: 0.0449
• Weighted residual factors for significantly intense reflections: 0.1233
• Weighted residual factors for all reflections included in the refinement: 0.1326
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No