Information card for entry 1518671

Structure parameters

• Chemical name: [Et3PPEt3][OTf]2
• Formula: C14 H30 F6 O6 P2 S2
• Calculated formula: C14 H30 F6 O6 P2 S2
• SMILES: S(=O)(=O)([O-])C(F)(F)F.[P+]([P+](CC)(CC)CC)(CC)(CC)CC.S(=O)(=O)([O-])C(F)(F)F
• Title of publication: Synthesis and reactivity of cyclo-tetra(stibinophosphonium) tetracations: redox and coordination chemistry of phosphine‒antimony complexes
• Authors of publication: Chitnis, Saurabh S.; Robertson, Alasdair P. M.; Burford, Neil; Weigand, Jan J.; Fischer, Roland
• Journal of publication: Chem. Sci.
• Year of publication: 2015
• Journal volume: 6
• Journal issue: 4
• Pages of publication: 2559
• a: 13.4271 ± 0.0009 Å
• b: 11.8532 ± 0.0008 Å
• c: 15.7504 ± 0.0011 Å
• α: 90°
• β: 110.993 ± 0.001°
• γ: 90°
• Cell volume: 2340.4 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173.15 K
• Number of distinct elements: 6
• 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: 0.0538
• Residual factor for significantly intense reflections: 0.0372
• Weighted residual factors for significantly intense reflections: 0.0875
• Weighted residual factors for all reflections included in the refinement: 0.0961
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No