Information card for entry 7014218

Structure parameters

• Formula: C38 H56 Al2 N2 O
• Calculated formula: C38 H56 Al2 N2 O
• SMILES: [Al]1([O]2[Al]([N](=Cc3c2c(cc(c3)C)C(N1c1c(cccc1C(C)C)C(C)C)C)c1c(cccc1C(C)C)C(C)C)(C)C)(C)C
• Title of publication: Bis(imino)phenoxide complexes of aluminium.
• Authors of publication: Gibson, Vernon C.; Nienhuis, Drew; Redshaw, Carl; White, Andrew J. P.; Williams, David J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 11
• Pages of publication: 1761 - 1765
• a: 12.2387 ± 0.0007 Å
• b: 16.1335 ± 0.001 Å
• c: 19.3515 ± 0.0009 Å
• α: 90°
• β: 94.321 ± 0.004°
• γ: 90°
• Cell volume: 3810.2 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0776
• Residual factor for significantly intense reflections: 0.067
• Weighted residual factors for all reflections: 0.1938
• Weighted residual factors for significantly intense reflections: 0.1801
• Goodness-of-fit parameter for all reflections: 1.026
• Goodness-of-fit parameter for significantly intense reflections: 1.055
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No