Information card for entry 7712381

Structure parameters

• Formula: C83 H76 Au F6 N O4 P3 Rh S2
• Calculated formula: C83 H76 Au F6 N O4 P3 Rh S2
• SMILES: [Au]([Rh]1234([P](c5ccccc5)(c5ccccc5)c5ccccc5)([P](c5ccccc5)(c5ccccc5)c5ccccc5)[c]56cccc[c]46[cH]3[cH]2[cH]15)[P](c1c(cccc1c1c(cccc1C)C)c1c(cccc1C)C)(C)C.S(=O)([O-])(=NS(=O)(=O)C(F)(F)F)C(F)(F)F.c1ccccc1.c1ccccc1
• Title of publication: Polarized Au(I)/Rh(I) Bimetallic Pairs Cooperatively Trigger Ligand non-Innocence and Bond Activation
• Authors of publication: González Alférez, Macarena; Moreno, Juan J.; Maya, Celia; Campos, Jesús
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 22.0242 ± 0.0017 Å
• b: 15.02 ± 0.001 Å
• c: 24.1969 ± 0.0018 Å
• α: 90°
• β: 110.708 ± 0.003°
• γ: 90°
• Cell volume: 7487.3 ± 1 ų
• Cell temperature: 193 K
• Ambient diffraction temperature: 193 K
• Number of distinct elements: 9
• 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: 0.0481
• Residual factor for significantly intense reflections: 0.0374
• Weighted residual factors for significantly intense reflections: 0.0921
• Weighted residual factors for all reflections included in the refinement: 0.0996
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No