Information card for entry 7002572

Structure parameters

• Formula: C62 H90 Al2 O4 S4
• Calculated formula: C62 H90 Al2 O4 S4
• Title of publication: Neutral and cationic aluminium complexes containing a chiral (OSSO)-type bis(phenolato) ligand: synthesis, structures and polymerization activity
• Authors of publication: Lian, Bing; Ma, Haiyan; Spaniol, Thomas P.; Okuda, Jun
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 41
• Pages of publication: 9033 - 9042
• a: 18.7075 ± 0.0005 Å
• b: 18.7075 ± 0.0005 Å
• c: 36.1564 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 12653.7 ± 0.7 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 5
• Space group number: 110
• Hermann-Mauguin space group symbol: I 41 c d
• Hall space group symbol: I 4bw -2c
• Residual factor for all reflections: 0.1325
• Residual factor for significantly intense reflections: 0.1051
• Weighted residual factors for significantly intense reflections: 0.2029
• Weighted residual factors for all reflections included in the refinement: 0.2179
• Goodness-of-fit parameter for all reflections included in the refinement: 1.124
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No