Information card for entry 4310498

Structure parameters

• Formula: C35 H25 F12 Os P2 S5
• Calculated formula: C35 H25 F12 Os P2 S5
• SMILES: [Os]1([S]=C(S1)Sc1c(c(cc(c1F)F)F)F)(Sc1c(c(cc(c1F)F)F)F)(Sc1c(c(cc(c1F)F)F)F)([P](c1ccccc1)(C)C)[P](c1ccccc1)(C)C
• Title of publication: Insertion reactions of [M(SR)~3~(PMe~2~Ph)~2~] with CS~2~ (M = Ru, Os; R = C~6~F~4~H, C~6~F~5~). X-ray structures of [Ru(S~2~CSC~6~F~4~H-4)~2~(PMe~2~Ph)~2~], trans thiolates- M(SR)~2~(S~2~CSR)(PMe~2~Ph)~2~] (M = Ru; R = C~6~F~5~ and M = Os; R = C~6~F~4~H-4) and trans thiolate-phosphine- [Os(SC~6~F~5~)~2~(S~2~CSC~6~F~5~)(PMe~2~Ph)~2~]
• Authors of publication: Maribel Arroyo; Sylvain Bernès; Joaquín Cerón; Jordi Rius; Hugo Torrens
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 986 - 992
• a: 11.59 ± 0.002 Å
• b: 12.764 ± 0.003 Å
• c: 13.828 ± 0.002 Å
• α: 102.28 ± 0.1°
• β: 96.27 ± 0.1°
• γ: 91.56 ± 0.02°
• Cell volume: 1984.2 ± 1.1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1084
• Residual factor for significantly intense reflections: 0.0398
• Weighted residual factors for significantly intense reflections: 0.0809
• Weighted residual factors for all reflections included in the refinement: 0.0994
• Goodness-of-fit parameter for all reflections included in the refinement: 1.008
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No