Information card for entry 7712383

Structure parameters

• Formula: C69 H70 Au F6 N O4 P3 Rh S2
• Calculated formula: C69 H70 Au F6 N O4 P3 Rh S2
• SMILES: [Au]([Rh]12345([P](c6ccccc6)(c6ccccc6)CC[P]1(c1ccccc1)c1ccccc1)[c]16[c]5([cH]2[cH]4[cH]36)cccc1)[P](C1CCCC1)(C1CCCC1)c1c(cccc1c1c(cccc1C)C)c1c(cccc1C)C.S(=O)([O-])(=NS(=O)(=O)C(F)(F)F)C(F)(F)F
• 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: 13.0982 ± 0.0004 Å
• b: 17.1018 ± 0.0004 Å
• c: 30.9379 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6930.2 ± 0.3 ų
• Cell temperature: 193 K
• Ambient diffraction temperature: 193 K
• Number of distinct elements: 9
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0789
• Residual factor for significantly intense reflections: 0.0408
• Weighted residual factors for significantly intense reflections: 0.0802
• Weighted residual factors for all reflections included in the refinement: 0.1006
• Goodness-of-fit parameter for all reflections included in the refinement: 1.104
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No