Information card for entry 7114131

Structure parameters

• Formula: C12 H24 B F4 O2 Rh S2
• Calculated formula: C12 H24 B F4 O2 Rh S2
• SMILES: [Rh]123([O]=S(C)C)([O]=S(C)C)[CH]4=[CH]1CC[CH]2=[CH]3CC4.[B](F)(F)(F)[F-]
• Title of publication: The first fully characterized neutral and cationic rhodium(i)-complexes containing DMSO as the only dative ligand; S-, O- and bridging S,O-bidentate binding modes
• Authors of publication: Dorta, Reto; Rozenberg, Haim; Milstein, David
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 7
• Pages of publication: 710
• a: 12.317 ± 0.003 Å
• b: 24.171 ± 0.005 Å
• c: 11.808 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3515.4 ± 1.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0371
• Residual factor for significantly intense reflections: 0.0322
• Weighted residual factors for significantly intense reflections: 0.0763
• Weighted residual factors for all reflections included in the refinement: 0.0791
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No