Information card for entry 7719130

Structure parameters

• Formula: C H5 F11 O3 S Sb2
• Calculated formula: C H5 F11 O3 S Sb2
• Title of publication: Shrinking of C-S bonds of organosulfonic acids in superacidic media-investigation of the protonation of methanesulfonic acid and benzenesulfonic acid and their limits.
• Authors of publication: Bockmair, Valentin; Xu, Tong; Hollenwäger, Dirk; Kornath, Andreas J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 32
• Pages of publication: 12169 - 12179
• a: 5.137 ± 0.0003 Å
• b: 14.3082 ± 0.0007 Å
• c: 16.1126 ± 0.0011 Å
• α: 90°
• β: 97.433 ± 0.005°
• γ: 90°
• Cell volume: 1174.34 ± 0.12 ų
• Cell temperature: 112 ± 2 K
• Ambient diffraction temperature: 112 ± 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: 0.0574
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.0915
• Weighted residual factors for all reflections included in the refinement: 0.0976
• Goodness-of-fit parameter for all reflections included in the refinement: 0.982
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No