Information card for entry 2226528

Structure parameters

• Chemical name: 4-Methoxyanilinium hexafluorophosphate monohydrate
• Formula: C7 H12 F6 N O2 P
• Calculated formula: C7 H12 F6 N O2 P
• Title of publication: 4-Methoxyanilinium hexafluorophosphate monohydrate
• Authors of publication: Yang, Yong-le; Fu, Xue-qun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 7
• Pages of publication: o1726
• a: 15.152 ± 0.003 Å
• b: 5.079 ± 0.001 Å
• c: 14.758 ± 0.003 Å
• α: 90°
• β: 94.26 ± 0.03°
• γ: 90°
• Cell volume: 1132.6 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0657
• Residual factor for significantly intense reflections: 0.0531
• Weighted residual factors for significantly intense reflections: 0.1362
• Weighted residual factors for all reflections included in the refinement: 0.1453
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes