Information card for entry 1573683

Structure parameters

• Chemical name: Triphenylsulfonium hexafluorophosphate
• Formula: C18 H15 F6 P S
• Calculated formula: C18 H15 F6 P S
• SMILES: [S+](c1ccccc1)(c1ccccc1)c1ccccc1.[P](F)(F)(F)(F)(F)[F-]
• Authors of publication: Artis, Rylan; Callaway, Waylan; Heyward, Elizabeth; Reyes, Naomi; Roberts, Gavin; Van Ostenbridge, Kaitlyn; Padgett, Clifford W.; Lynch, Will E.
• Journal of publication: Acta Crystallographica, Section E: Crystallographic Communications
• Year of publication: 2025
• Journal volume: 81
• Journal issue: 2
• Pages of publication: 114 - 119
• a: 8.4524 ± 0.0002 Å
• b: 18.1483 ± 0.0005 Å
• c: 11.4344 ± 0.0003 Å
• α: 90°
• β: 98.251 ± 0.002°
• γ: 90°
• Cell volume: 1735.84 ± 0.08 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 5
• 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: 0.0636
• Residual factor for significantly intense reflections: 0.0566
• Weighted residual factors for significantly intense reflections: 0.1516
• Weighted residual factors for all reflections included in the refinement: 0.158
• Goodness-of-fit parameter for all reflections included in the refinement: 1.105
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No