Information card for entry 1568370

Structure parameters

• Formula: C12 H20 F6 N2 O4 S2
• Calculated formula: C12 H20 F6 N2 O4 S2
• Title of publication: Insights into structure-property relationships in ionic liquids using cyclic perfluoroalkylsulfonylimides.
• Authors of publication: Bejaoui, Younes K. J.; Philippi, Frederik; Stammler, Hans-Georg; Radacki, Krzysztof; Zapf, Ludwig; Schopper, Nils; Goloviznina, Kateryna; Maibom, Kristina A. M.; Graf, Roland; Sprenger, Jan A. P.; Bertermann, Rüdiger; Braunschweig, Holger; Welton, Tom; Ignat'ev, Nikolai V.; Finze, Maik
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 8
• Pages of publication: 2200 - 2214
• a: 8.981 ± 0.0001 Å
• b: 9.3656 ± 0.0001 Å
• c: 11.9008 ± 0.0002 Å
• α: 70.207 ± 0.001°
• β: 75.403 ± 0.001°
• γ: 71.869 ± 0.001°
• Cell volume: 882.98 ± 0.02 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0712
• Residual factor for significantly intense reflections: 0.0698
• Weighted residual factors for significantly intense reflections: 0.1911
• Weighted residual factors for all reflections included in the refinement: 0.1931
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No