Information card for entry 7251202

Structure parameters

• Formula: C4 H3 As F13 N O
• Calculated formula: C4 H3 As F13 N O
• Title of publication: Hydrogen-bonded salt cocrystals of xenon difluoride and protonated perfluoroamides
• Authors of publication: Uran, Erik; Lozinšek, Matic
• Journal of publication: CrystEngComm
• Year of publication: 2025
• a: 6.17592 ± 0.00015 Å
• b: 7.94187 ± 0.00019 Å
• c: 21.7914 ± 0.0005 Å
• α: 90°
• β: 96.014 ± 0.002°
• γ: 90°
• Cell volume: 1062.95 ± 0.04 ų
• Cell temperature: 100.02 ± 0.18 K
• Ambient diffraction temperature: 100.02 ± 0.18 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: 0.032
• Residual factor for significantly intense reflections: 0.0265
• Weighted residual factors for significantly intense reflections: 0.0655
• Weighted residual factors for all reflections included in the refinement: 0.0677
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.56087 Å
• Diffraction radiation type: AgKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No