Information card for entry 7123379

Structure parameters

• Formula: C18 H39 B F5 N
• Calculated formula: C18 H39 B F5 N
• Title of publication: The pentafluoroethyltrihydridoborate anion: From shock sensitive salts to stable room temperature ionic liquids
• Authors of publication: Hennig, Philipp T.; Sprenger, Jan Arke Peter; Schneider, Leon; Ignat'ev, Nikolai; Finze, Maik
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 8.8965 ± 0.0016 Å
• b: 16.17 ± 0.003 Å
• c: 15.312 ± 0.003 Å
• α: 90°
• β: 98.429 ± 0.006°
• γ: 90°
• Cell volume: 2178.9 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.0595
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.1145
• Weighted residual factors for all reflections included in the refinement: 0.1241
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No