Information card for entry 7115186

Structure parameters

• Formula: C23 H33 Al N2 O
• Calculated formula: C23 H33 Al N2 O
• SMILES: [Al]12([n]3ccccc3C[N]1=Cc1cc(cc(c1O2)C(C)(C)C)C(C)(C)C)(C)C
• Title of publication: Pendant arm Schiff base complexes of aluminium as ethylene polymerisation catalysts
• Authors of publication: Cameron, Paul A.; Gibson, Vernon C.; Redshaw, Carl; Segal, John A.; Bruce, Michael D.; White, Andrew J. P.; Williams, David J.
• Journal of publication: Chemical Communications
• Year of publication: 1999
• Journal issue: 18
• Pages of publication: 1883
• a: 15.009 ± 0.002 Å
• b: 12.2073 ± 0.0015 Å
• c: 14.1285 ± 0.0013 Å
• α: 90°
• β: 116.357 ± 0.006°
• γ: 90°
• Cell volume: 2319.5 ± 0.5 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: 0.0897
• Residual factor for significantly intense reflections: 0.0539
• Weighted residual factors for all reflections: 0.163
• Weighted residual factors for significantly intense reflections: 0.1364
• Goodness-of-fit parameter for all reflections: 1.014
• Goodness-of-fit parameter for significantly intense reflections: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No