Information card for entry 7108784

Structure parameters

• Formula: C24 H40 F6 N2 O3 S
• Calculated formula: C24 H40 F6 N2 O3 S
• Title of publication: Anion recognition and transport properties of sulfamide-, phosphoric triamide- and thiophosphoric triamide-based receptors
• Authors of publication: Philippa B. Cranwell; Jennifer R. Hiscock; Cally J. E. Haynes; Mark E. Light; Neil J. Wells; Philip A. Gale
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2013
• Journal volume: 49
• Journal issue: 9
• Pages of publication: 874 - 876
• a: 23.94 ± 0.019 Å
• b: 16.839 ± 0.011 Å
• c: 29.83 ± 0.02 Å
• α: 90°
• β: 109.479 ± 0.011°
• γ: 90°
• Cell volume: 11337 ± 14 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.159
• Residual factor for significantly intense reflections: 0.1274
• Weighted residual factors for significantly intense reflections: 0.2168
• Weighted residual factors for all reflections included in the refinement: 0.2321
• Goodness-of-fit parameter for all reflections included in the refinement: 1.142
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No