Information card for entry 2217682

Structure parameters

• Chemical name: 1-Benzylimidazolium hexafluorophosphate‒1-benzylimidazole (1/1)
• Formula: C20 H21 F6 N4 P
• Calculated formula: C20 H21 F6 N4 P
• Title of publication: 1-Benzylimidazolium hexafluorophosphate‒1-benzylimidazole (1/1)
• Authors of publication: Yan Zang; Xiu-Mei Wu; Zhan-Ying Zheng; Hai-Bin Song; Qing-Xiang Liu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 2
• Pages of publication: o478 - o478
• a: 6.6459 ± 0.0004 Å
• b: 6.9825 ± 0.0004 Å
• c: 22.3558 ± 0.0012 Å
• α: 90°
• β: 97.109 ± 0.001°
• γ: 90°
• Cell volume: 1029.45 ± 0.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0425
• Residual factor for significantly intense reflections: 0.0369
• Weighted residual factors for significantly intense reflections: 0.1102
• Weighted residual factors for all reflections included in the refinement: 0.1161
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes