Information card for entry 7717021

Structure parameters

• Formula: C47.5 H50.5 Au F6 O0.75 P3 S0.75
• Calculated formula: C47.5 H50.5 Au F6 O0.75 P3 S0.75
• Title of publication: Post-metallation functionalization of the [(C^C)Au(P^P)]+ scaffold through a hydrothiolation reaction
• Authors of publication: Yang, Jeannine; Soep, Clément; Forté, Jérémy; Dossmann, Heloise; Bertrand, Benoît
• Journal of publication: Dalton Transactions
• Year of publication: 2024
• a: 9.9276 ± 0.0009 Å
• b: 10.8859 ± 0.001 Å
• c: 22.748 ± 0.002 Å
• α: 100.721 ± 0.001°
• β: 92.65 ± 0.002°
• γ: 91.87 ± 0.002°
• Cell volume: 2410.8 ± 0.4 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0936
• Residual factor for significantly intense reflections: 0.0699
• Weighted residual factors for significantly intense reflections: 0.1643
• Weighted residual factors for all reflections included in the refinement: 0.1727
• Goodness-of-fit parameter for all reflections included in the refinement: 1.213
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No