Information card for entry 4316102

Structure parameters

• Chemical name: tetramethylammonium hdimethyltetrafluorophosphate
• Formula: C6 H18 F4 N P
• Calculated formula: C6 H18 F4 N P
• SMILES: CP(C)(F)(F)(F)F.C[N+](C)(C)C
• Title of publication: Preparation and Properties of Dimethyltetrafluorophosphate
• Authors of publication: Christian Hohenstein; Andreas Kornath; Frank Neumann; Ralf Ludwig
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 6421 - 6427
• a: 13.035 ± 0.003 Å
• b: 7.998 ± 0.002 Å
• c: 10.238 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1067.4 ± 0.4 ų
• Cell temperature: 157 ± 2 K
• Ambient diffraction temperature: 157 ± 2 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0784
• Residual factor for significantly intense reflections: 0.0325
• Weighted residual factors for all reflections: 0.2132
• Weighted residual factors for significantly intense reflections: 0.0797
• Goodness-of-fit parameter for all reflections: 0.945
• Goodness-of-fit parameter for significantly intense reflections: 1.088
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No