Information card for entry 7704472

Structure parameters

• Formula: C39 H30 As2 F3 N O3 S
• Calculated formula: C39 H30 As2 F3 N O3 S
• Title of publication: Reactions of PhIX₂ I(iii) oxidants with heavy triphenyl pnictines.
• Authors of publication: Egalahewa, Sathsara; Aprile, Antonino; Dutton, Jason L.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 22
• Pages of publication: 7507 - 7513
• a: 9.91 ± 0.002 Å
• b: 41.067 ± 0.008 Å
• c: 10.049 ± 0.002 Å
• α: 90°
• β: 119.29 ± 0.03°
• γ: 90°
• Cell volume: 3566.8 ± 1.6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.099
• Residual factor for significantly intense reflections: 0.0935
• Weighted residual factors for significantly intense reflections: 0.2843
• Weighted residual factors for all reflections included in the refinement: 0.2913
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No