Information card for entry 7054101

Structure parameters

• Formula: C33.5 H49 Al N2 O2
• Calculated formula: C33.5 H49 Al N2 O2
• Title of publication: Al(iii)‒homopiperazine complexes and their exploitation for the production of polyesters
• Authors of publication: Hancock, Stuart L.; Jones, Matthew D.; Langridge, Conrad J.; Mahon, Mary F.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2012
• Journal volume: 36
• Journal issue: 9
• Pages of publication: 1891
• a: 14.781 ± 0.0002 Å
• b: 15.101 ± 0.0002 Å
• c: 29.119 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6499.59 ± 0.15 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0676
• Residual factor for significantly intense reflections: 0.0619
• Weighted residual factors for significantly intense reflections: 0.1606
• Weighted residual factors for all reflections included in the refinement: 0.1651
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No