Information card for entry 4118660

Structure parameters

• Formula: C33 H24 F3 O3 S Sb
• Calculated formula: C33 H24 F3 O3 S Sb
• SMILES: [Sb+](c1c2ccccc2cc2ccccc12)(c1ccccc1)(c1ccccc1)c1ccccc1.S(=O)(=O)([O-])C(F)(F)F
• Title of publication: Stibonium Ions for the Fluorescence Turn-On Sensing of F-in Drinking Water at Parts per Million Concentrations
• Authors of publication: Iou-Sheng Ke; Mykhaylo Myahkostupov; Felix N. Castellano; François P. Gabbaï
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2012
• Journal volume: 134
• Pages of publication: 15309 - 15311
• a: 9.545 ± 0.002 Å
• b: 11.803 ± 0.003 Å
• c: 13.848 ± 0.004 Å
• α: 94.664 ± 0.003°
• β: 107.251 ± 0.002°
• γ: 106.439 ± 0.003°
• Cell volume: 1405.6 ± 0.6 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0226
• Residual factor for significantly intense reflections: 0.0211
• Weighted residual factors for significantly intense reflections: 0.0516
• Weighted residual factors for all reflections included in the refinement: 0.0523
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No