Information card for entry 4321982

Structure parameters

• Formula: F4 Li O2 Re
• Calculated formula: F4 Li O2 Re
• SMILES: F[Re](=O)(F)(F)(F)=O.[Li+]
• Title of publication: Lewis Acid Behavior of ReO2F3: Synthesis of (ReO2F3)\ιnfty, ReO2F4-, Re2O4F7-, Re3O6F10-, and ReO2F3(CH3CN) and Study by NMR Spectroscopy, Raman Spectroscopy, and Density Functional Theory Calculations; and X-ray Structures of [Li][ReO2F4], [K][Re2O4F7], [K][Re2O4F7].2ReO2F3, [Cs][Re3O6F10], and ReO3F(CH3CN)2.CH3CN
• Authors of publication: William J. Casteel; David A. Dixon; Nicolas LeBlond; Philippa E. Lock; Hélène P. A. Mercier; Gary J. Schrobilgen
• Journal of publication: Inorganic Chemistry
• Year of publication: 1999
• Journal volume: 38
• Pages of publication: 2340 - 2358
• a: 4.727 ± 0.003 Å
• b: 4.727 ± 0.003 Å
• c: 8.88 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 198.4 ± 0.2 ų
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 113
• Hermann-Mauguin space group symbol: P -4 21 m
• Hall space group symbol: P -4 2ab
• Residual factor for all reflections: 0.0397
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for all reflections: 0.1084
• Weighted residual factors for significantly intense reflections: 0.1029
• Goodness-of-fit parameter for all reflections: 1.207
• Goodness-of-fit parameter for significantly intense reflections: 1.2
• Diffraction radiation wavelength: 0.56086 Å
• Diffraction radiation type: AgKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No