Information card for entry 7026436

Structure parameters

• Formula: C44 H54 Al N2 P
• Calculated formula: C44 H54 Al N2 P
• SMILES: P1(=[N]([Al](N(c2c1cccc2)c1c(C(C)C)cccc1C(C)C)(C)C)c1c(C(C)C)cccc1C(C)C)(c1ccccc1)c1ccccc1
• Title of publication: Aluminium complexes of bidentate N,O- and N,N-ligands derived from oxidative functionalization of amido phosphines: synthesis, structure and reactivity.
• Authors of publication: Liang, Lan-Chang; Chen, Feng-Yi; Huang, Mei-Hui; Cheng, Liang-Chien; Li, Chun-Wei; Lee, Hon Man
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 41
• Pages of publication: 9941 - 9951
• a: 14.8344 ± 0.0003 Å
• b: 12.2348 ± 0.0002 Å
• c: 22.0762 ± 0.0004 Å
• α: 90°
• β: 91.695 ± 0.001°
• γ: 90°
• Cell volume: 4004.99 ± 0.13 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.1762
• Residual factor for significantly intense reflections: 0.128
• Weighted residual factors for significantly intense reflections: 0.3391
• Weighted residual factors for all reflections included in the refinement: 0.3698
• Goodness-of-fit parameter for all reflections included in the refinement: 1.172
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No