Information card for entry 7010981

Structure parameters

• Formula: C21 H37 Al N2 O
• Calculated formula: C21 H37 Al N2 O
• SMILES: [Al]12([N](CC[N]1=Cc1cc(cc(c1O2)C(C)(C)C)C(C)(C)C)(C)C)(C)C
• Title of publication: Synthesis and characterisation of neutral and cationic alkyl aluminium complexes bearing N,O-Schiff base chelates with pendant donor arms
• Authors of publication: Paul A. Cameron; Vernon C. Gibson; Carl Redshaw; John A. Segal; Andrew J. P. White; David J. Williams
• Journal of publication: J. Chem. Soc., Dalton Trans.
• Year of publication: 2002
• Journal issue: 3
• Pages of publication: 415 - 422
• a: 10.332 ± 0.002 Å
• b: 24.982 ± 0.004 Å
• c: 9.729 ± 0.002 Å
• α: 90°
• β: 115.984 ± 0.012°
• γ: 90°
• Cell volume: 2257.4 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.1359
• Residual factor for significantly intense reflections: 0.0673
• Weighted residual factors for all reflections: 0.1994
• Weighted residual factors for significantly intense reflections: 0.1557
• Goodness-of-fit parameter for all reflections: 0.993
• Goodness-of-fit parameter for significantly intense reflections: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No