Information card for entry 4330852

Structure parameters

• Chemical name: trans-Difluoro-tetrakis(aqua)-aluminium bis(pyridinium) trichloride
• Formula: C10 H20 Al Cl3 F2 N2 O4
• Calculated formula: C10 H20 Al Cl3 F2 N2 O4
• Title of publication: Syntheses and Characterization of Salts with the [Al(D)4F2]+ Cation (D = Pyridine or Water)
• Authors of publication: Anton Dimitrov; Detlef Heidemann; Khalaf I. Khallow; Erhard Kemnitz
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 11612 - 11622
• a: 5.0967 ± 0.0003 Å
• b: 19.7672 ± 0.0011 Å
• c: 9.0423 ± 0.0007 Å
• α: 90°
• β: 103.089 ± 0.006°
• γ: 90°
• Cell volume: 887.32 ± 0.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0507
• Residual factor for significantly intense reflections: 0.0388
• Weighted residual factors for significantly intense reflections: 0.0774
• Weighted residual factors for all reflections included in the refinement: 0.081
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No