Information card for entry 4336741

Structure parameters

• Formula: C17 H11 F6 Li N4 O4 S2
• Calculated formula: C17 H11 F6 Li N4 O4 S2
• Title of publication: Coordination of Terpyridine to Li+ in Two Different Ionic Liquids
• Authors of publication: Klaus Pokorny; Matthias Schmeisser; Frank Hampel; Achim Zahl; Ralph Puchta; Rudi van Eldik
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 13167 - 13178
• a: 9.7851 ± 0.0002 Å
• b: 17.2371 ± 0.0004 Å
• c: 13.078 ± 0.0003 Å
• α: 90°
• β: 101.16 ± 0.002°
• γ: 90°
• Cell volume: 2164.11 ± 0.08 ų
• Cell temperature: 173 ± 0.1 K
• Ambient diffraction temperature: 173 ± 0.1 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: 0.0569
• Residual factor for significantly intense reflections: 0.0438
• Weighted residual factors for significantly intense reflections: 0.1042
• Weighted residual factors for all reflections included in the refinement: 0.1155
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No