Information card for entry 1543646

Structure parameters

• Formula: C37 H29 Cl4 F15 O3 P Sb
• Calculated formula: C37 H29 Cl4 F15 O3 P Sb
• SMILES: [Sb]1(OC[P+](C(C)(C)C)(C(C)(C)C)C(C)(C)C)(c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)Oc2c(O1)c(Cl)c(Cl)c(Cl)c2Cl
• Title of publication: Fluorinated antimony(v) derivatives: strong Lewis acidic properties and application to the complexation of formaldehyde in aqueous solutions
• Authors of publication: Tofan, Daniel; Gabbaï, François P.
• Journal of publication: Chem. Sci.
• Year of publication: 2016
• Journal volume: 7
• Journal issue: 11
• Pages of publication: 6768
• a: 17.7168 ± 0.001 Å
• b: 11.1989 ± 0.0007 Å
• c: 20.8571 ± 0.0012 Å
• α: 90°
• β: 105.423 ± 0.003°
• γ: 90°
• Cell volume: 3989.2 ± 0.4 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 7
• 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: 0.0516
• Residual factor for significantly intense reflections: 0.0328
• Weighted residual factors for significantly intense reflections: 0.0635
• Weighted residual factors for all reflections included in the refinement: 0.0714
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No