Information card for entry 2214800

Structure parameters

• Common name: [NBu4]+[((CF3)3CO)3Al-F-Al(OC(CF3)3)3]-
• Chemical name: Tetra-n-butylammonium μ-fluorido-bis{tris[2,2,2-trifluoro-1,1-bis(trifluoromethyl)ethanolato- κO]aluminate(III)}
• Formula: C40 H36 Al2 F55 N O6
• Calculated formula: C40 H36 Al2 F55 N O6
• Title of publication: Tetra-<i>n</i>-butylammonium μ-fluorido-bis{tris[2,2,2-trifluoro-1,1-bis(trifluoromethyl)ethanolato-κ<i>O</i>]aluminate(III)}
• Authors of publication: Krossing, Ingo; Raabe, Ines
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 8
• Pages of publication: m2144 - m2144
• a: 12.822 ± 0.003 Å
• b: 19.23 ± 0.004 Å
• c: 24.871 ± 0.005 Å
• α: 88.35 ± 0.03°
• β: 86.72 ± 0.03°
• γ: 89.21 ± 0.03°
• Cell volume: 6119 ± 2 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1049
• Residual factor for significantly intense reflections: 0.0747
• Weighted residual factors for significantly intense reflections: 0.1959
• Weighted residual factors for all reflections included in the refinement: 0.2162
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes