Information card for entry 2236480

Structure parameters

• Chemical name: 1-Butyl-3-ethyl-1<i>H</i>-benzimidazol-3-ium tetrafluoroborate
• Formula: C13 H19 B F4 N2
• Calculated formula: C13 H19 B F4 N2
• Title of publication: 1-Butyl-3-ethyl-1<i>H</i>-benzimidazol-3-ium tetrafluoroborate
• Authors of publication: Junge, Denise M.; Scadova, Derek R.; Golen, James A.; Jasinski, Jerry P.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 10
• Pages of publication: o2862
• a: 11.0043 ± 0.0013 Å
• b: 12.0372 ± 0.0009 Å
• c: 11.3693 ± 0.001 Å
• α: 90°
• β: 99.312 ± 0.009°
• γ: 90°
• Cell volume: 1486.1 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0509
• Residual factor for significantly intense reflections: 0.0484
• Weighted residual factors for significantly intense reflections: 0.1342
• Weighted residual factors for all reflections included in the refinement: 0.1366
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes