Information card for entry 1518230

Structure parameters

• Common name: (GBL)1:LiCF3SO3
• Formula: C15 H18 F9 Li3 O15 S3
• Calculated formula: C15 H18 F9 Li3 O15 S3
• Title of publication: Structural Interactions within Lithium Salt Solvates: Cyclic Carbonates and Esters
• Authors of publication: Seo, Daniel M.; Afroz, Taliman; Allen, Joshua L.; Boyle, Paul D.; Trulove, Paul C.; De Long, Hugh C.; Henderson, Wesley A.
• Journal of publication: The Journal of Physical Chemistry C
• Year of publication: 2014
• Journal volume: 118
• Journal issue: 45
• Pages of publication: 25884
• a: 10.4705 ± 0.0004 Å
• b: 17.4648 ± 0.0007 Å
• c: 19.037 ± 0.0007 Å
• α: 90°
• β: 122.592 ± 0.0016°
• γ: 90°
• Cell volume: 2933 ± 0.2 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0916
• Residual factor for significantly intense reflections: 0.0557
• Weighted residual factors for significantly intense reflections: 0.1406
• Weighted residual factors for all reflections included in the refinement: 0.1628
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No