Information card for entry 1559062

Structure parameters

• Chemical name: C30H24SBF4Sb
• Formula: C30 H24 B F4 S Sb
• Calculated formula: C30 H24 B F4 S Sb
• SMILES: [Sb+](c1c(Sc2ccccc2)cccc1)(c1ccccc1)(c1ccccc1)c1ccccc1.[B](F)(F)(F)[F-]
• Title of publication: Redox-controlled chalcogen and pnictogen bonding: the case of a sulfonium/stibonium dication as a preanionophore for chloride anion transport
• Authors of publication: Park, Gyeongjin; Gabbaï, François P.
• Journal of publication: Chemical Science
• Year of publication: 2020
• a: 7.9877 ± 0.0011 Å
• b: 15.558 ± 0.002 Å
• c: 21.445 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2665 ± 0.6 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110.01 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0312
• Residual factor for significantly intense reflections: 0.0289
• Weighted residual factors for significantly intense reflections: 0.075
• Weighted residual factors for all reflections included in the refinement: 0.077
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No