Information card for entry 7049017

Structure parameters

• Formula: C32 H14 B F24 Li O
• Calculated formula: C32 H14 B F24 Li O
• Title of publication: Solvent-free anhydrous Li+, Na+ and K+ salts of [B(3,5-(CF3)2C6H3)4]−, [BArF4]−. Improved synthesis and solid-state structures
• Authors of publication: Martínez-Martínez, Antonio J.; Weller, Andrew S.
• Journal of publication: Dalton Transactions
• Year of publication: 2019
• a: 13.45985 ± 0.00014 Å
• b: 13.45985 ± 0.00014 Å
• c: 9.66072 ± 0.00016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1750.21 ± 0.04 ų
• Cell temperature: 150 ± 0.3 K
• Ambient diffraction temperature: 150 ± 0.3 K
• Number of distinct elements: 6
• Space group number: 85
• Hermann-Mauguin space group symbol: P 4/n
• Hall space group symbol: -P 4a
• Residual factor for all reflections: 0.0537
• Residual factor for significantly intense reflections: 0.0523
• Weighted residual factors for significantly intense reflections: 0.138
• Weighted residual factors for all reflections included in the refinement: 0.139
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No