Information card for entry 8104653

Structure parameters

• Chemical name: 3-(2-ethoxy-2-oxoethyl)-1-ethyl-1H-imidazol-3-ium hexafluoridophos-phate(V)
• Formula: C9 H15 F6 N2 O2 P
• Calculated formula: C9 H15 F6 N2 O2 P
• Title of publication: Crystal structure of 3-(2-ethoxy-2-oxoethyl)-1-ethyl-1H-imidazol-3-ium hexafluoridophos-phate(V), C9H15F6N2O2P
• Authors of publication: Yuan, Kun; Xiong, Wan-Ming; Nie, Xu-Liang; Peng, Da-Yong; Chen, Jing
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2021
• Journal volume: 236
• Journal issue: 5
• Pages of publication: 1015 - 1017
• a: 8.3781 ± 0.0015 Å
• b: 13.97 ± 0.003 Å
• c: 12.904 ± 0.002 Å
• α: 90°
• β: 104.5 ± 0.002°
• γ: 90°
• Cell volume: 1462.2 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• 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: 0.0863
• Residual factor for significantly intense reflections: 0.0677
• Weighted residual factors for significantly intense reflections: 0.1713
• Weighted residual factors for all reflections included in the refinement: 0.1977
• Goodness-of-fit parameter for all reflections included in the refinement: 0.988
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No