Information card for entry 4338001

Structure parameters

• Common name: NaN(C6F5)(C4F9)
• Chemical name: Sodium-(pentafluorophenyl)(nonafluoro-tert-butyl)amide
• Formula: C10 F14 N Na
• Calculated formula: C10 F14 N Na
• SMILES: [Na+].Fc1c([N-]C(C(F)(F)F)(C(F)(F)F)C(F)(F)F)c(F)c(F)c(F)c1F
• Title of publication: The New NH-Acid HN(C6F5)(C(CF3)3) and Its Crystalline and Volatile Alkaline and Earth Alkaline Metal Salts.
• Authors of publication: Kögel, Julius F; Finger, Lars H.; Frank, Nicolas; Sundermeyer, Jörg
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 7
• Pages of publication: 3839
• a: 6.9421 ± 0.0005 Å
• b: 9.874 ± 0.0006 Å
• c: 10.4269 ± 0.0006 Å
• α: 64.098 ± 0.0017°
• β: 75.0294 ± 0.0019°
• γ: 74.61 ± 0.002°
• Cell volume: 611.46 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0416
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.0907
• Weighted residual factors for all reflections included in the refinement: 0.0956
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No