Information card for entry 2211493

Structure parameters

• Common name: Aluminiumacetylacetonat
• Chemical name: γ-Tris(2,4-pentanedionato-κ^2^O,O')aluminium(III)
• Formula: C15 H21 Al O6
• Calculated formula: C15 H21 Al O6
• SMILES: [Al]123(OC(=CC(=[O]1)C)C)(OC(=CC(=[O]2)C)C)[O]=C(C)C=C(O3)C
• Title of publication: γ-Tris(2,4-pentanedionato-κ^2^<i>O</i>,<i>O</i>')aluminium(III) at 110 K
• Authors of publication: Chrzanowski, Lars S. von; Lutz, Martin; Spek, Anthony L.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 12
• Pages of publication: m3318 - m3320
• a: 15.51663 ± 0.00018 Å
• b: 31.9596 ± 0.0007 Å
• c: 13.2306 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6561.12 ± 0.19 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0413
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.0715
• Weighted residual factors for all reflections included in the refinement: 0.0759
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes