Information card for entry 7010061

Structure parameters

• Formula: C74 H60 B2 F8 O2 P4 Rh2 S2
• Calculated formula: C74 H58 B2 F8 O3 P4 Rh2 S2
• Title of publication: Rhodium and iridium complexes with thiolate and tertiary phosphine ligands. The synthesis and structures of trans-[Ir(SC6H3Cl2-2,6)(CO)(PPh3)2], [Rh2(?-SC6H3Pri3-2,4,6)2(CO)2(PPh3)2], [Rh2H2(?-SC6H4PPh2-2)2(CO)2(PPh3)2][BF4]2, and [Rh2I6(MeSC6H4PPh2-2)2]
• Authors of publication: Dilworth, Jonathan R.; Morales, David; Zheng, Yifan
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 17
• Pages of publication: 3007
• a: 11.931 ± 0.002 Å
• b: 13.554 ± 0.009 Å
• c: 22.814 ± 0.004 Å
• α: 97.7 ± 0.03°
• β: 97.87 ± 0.01°
• γ: 97.41 ± 0.04°
• Cell volume: 3581 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1009
• Residual factor for significantly intense reflections: 0.0685
• Weighted residual factors for all reflections: 0.2476
• Weighted residual factors for significantly intense reflections: 0.1951
• Goodness-of-fit parameter for all reflections: 1.008
• Goodness-of-fit parameter for significantly intense reflections: 0.958
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No