Information card for entry 7707934

Structure parameters

• Formula: C39 H51 F3 O3 P Rh S Si2
• Calculated formula: C39 H51 F3 O3 P Rh S Si2
• SMILES: [Rh]12([P](c3c(C[Si]1(C(C)C)C(C)C)cccc3)(c1ccccc1)c1ccccc1C[Si]2(C(C)C)C(C)C)OS(=O)(=O)C(F)(F)F.c1ccccc1
• Title of publication: 14-Electron Rh and Ir silylphosphine complexes and their catalytic activity in alkene functionalization with hydrosilanes.
• Authors of publication: Abeynayake, Niroshani S.; Zamora-Moreno, Julio; Gorla, Saidulu; Donnadieu, Bruno; Muñoz-Hernández, Miguel A; Montiel-Palma, Virginia
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 34
• Pages of publication: 11783 - 11792
• a: 11.7311 ± 0.0008 Å
• b: 21.7488 ± 0.0015 Å
• c: 15.5316 ± 0.0011 Å
• α: 90°
• β: 93.067 ± 0.002°
• γ: 90°
• Cell volume: 3957 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0369
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.0955
• Weighted residual factors for all reflections included in the refinement: 0.0968
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No