Information card for entry 7251206

Structure parameters

• Formula: C4 H7 As F12 N2 O3
• Calculated formula: C4 H7 As F12 N2 O3
• 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: 11.5349 ± 0.0002 Å
• b: 14.0649 ± 0.0003 Å
• c: 7.78994 ± 0.00014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1263.82 ± 0.04 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 6
• 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: 0.0437
• Residual factor for significantly intense reflections: 0.0366
• Weighted residual factors for significantly intense reflections: 0.081
• Weighted residual factors for all reflections included in the refinement: 0.0853
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No