Information card for entry 7130835

Structure parameters

• Common name: TSCl
• Chemical name: Tetrakis(4-sulfonylchloridephenyl)methane
• Formula: C25 H16 Cl4 O8 S4
• Calculated formula: C25 H16 Cl4 O8 S4
• Title of publication: Targeted design of porous materials without strong, directional interactions
• Authors of publication: O'Shaughnessy, Megan; Spackman, Peter A.; Little, Marc; Catalano, Luca; James, Alex Michael; Day, Graeme Matthew; Cooper, Andrew
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 13.6104 ± 0.0008 Å
• b: 13.6104 ± 0.0008 Å
• c: 9.8 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1815.38 ± 0.18 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 5
• Space group number: 82
• Hermann-Mauguin space group symbol: I -4
• Hall space group symbol: I -4
• Residual factor for all reflections: 0.0541
• Residual factor for significantly intense reflections: 0.0483
• Weighted residual factors for significantly intense reflections: 0.1293
• Weighted residual factors for all reflections included in the refinement: 0.1345
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No