Information card for entry 7240486

Structure parameters

• Chemical name: [4-(3-fluorphenoxy)phenyl]triphenylphosphonium bistriflimide
• Formula: C32 H23 F7 N O5 P S2
• Calculated formula: C32 H23 F7 N O5 P S2
• Title of publication: Tuning the melting point of selected ionic liquids through adjustment of the cation's dipole moment.
• Authors of publication: Rabideau, Brooks D.; Soltani, Mohammad; Parker, Rome A.; Siu, Benjamin; Salter, E. Alan; Wierzbicki, Andrzej; West, Kevin N.; Davis, Jr, James H
• Journal of publication: Physical chemistry chemical physics : PCCP
• Year of publication: 2020
• Journal volume: 22
• Journal issue: 21
• Pages of publication: 12301 - 12311
• a: 18.0534 ± 0.0013 Å
• b: 19.0695 ± 0.0014 Å
• c: 20.2712 ± 0.0015 Å
• α: 90°
• β: 114.239 ± 0.003°
• γ: 90°
• Cell volume: 6363.5 ± 0.8 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0955
• Residual factor for significantly intense reflections: 0.0534
• Weighted residual factors for significantly intense reflections: 0.1333
• Weighted residual factors for all reflections included in the refinement: 0.145
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No