Information card for entry 2234220

Structure parameters

• Common name: 4-{[(4-fluorophenyl)sulfonyl]amino}phenyl 4-fluorobenzenesulfonate
• Chemical name: 4-(4-Fluorobenzenesulfonamido)phenyl 4-fluorobenzenesulfonate
• Formula: C18 H13 F2 N O5 S2
• Calculated formula: C18 H13 F2 N O5 S2
• Title of publication: 4-(4-Fluorobenzenesulfonamido)phenyl 4-fluorobenzenesulfonate
• Authors of publication: Al-Najjar, Belal O.; Tengku Muhammad, Tengku Sifzizul; Wahab, Habibah A.; Rosli, Mohd Mustaqim; Fun, Hoong-Kun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 4
• Pages of publication: o1094
• a: 8.9683 ± 0.0001 Å
• b: 11.0323 ± 0.0001 Å
• c: 9.3314 ± 0.0001 Å
• α: 90°
• β: 102.363 ± 0.001°
• γ: 90°
• Cell volume: 901.848 ± 0.017 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 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: 0.0392
• Residual factor for significantly intense reflections: 0.0355
• Weighted residual factors for significantly intense reflections: 0.0971
• Weighted residual factors for all reflections included in the refinement: 0.0998
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes