Information card for entry 7225962

Structure parameters

• Formula: C66 H91 Al F12 N6 O14 S4
• Calculated formula: C66 H91 Al F12 N6 O14 S4
• Title of publication: Organoaluminum(III) complexes of the bis-N,N’-(2,6-diisopropylphenyl)imidazolin-2-imine ligand
• Authors of publication: Todd, Angela D.K.; McClennan, William L.; Masuda, Jason Douglas
• Journal of publication: RSC Adv.
• Year of publication: 2016
• a: 12.6935 ± 0.0015 Å
• b: 16.0668 ± 0.0019 Å
• c: 19.437 ± 0.002 Å
• α: 90°
• β: 102.198 ± 0.001°
• γ: 90°
• Cell volume: 3874.6 ± 0.8 ų
• Cell temperature: 125 ± 2 K
• Ambient diffraction temperature: 125 ± 2 K
• Number of distinct elements: 7
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.058
• Residual factor for significantly intense reflections: 0.0457
• Weighted residual factors for significantly intense reflections: 0.1063
• Weighted residual factors for all reflections included in the refinement: 0.1136
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No