Information card for entry 7054526

Structure parameters

• Common name: [Pt(p-SC6F4CF3)(triphos)][OTf]
• Chemical name: Platinum-triphos-SC7F7 Triflate
• Formula: C42 H33 F10 O3 P3 Pt S2
• Calculated formula: C42 H33 F10 O3 P3 Pt S2
• SMILES: [Pt]12(Sc3c(F)c(F)c(c(F)c3F)C(F)(F)F)[P](c3ccccc3)(c3ccccc3)CC[P]1(c1ccccc1)CC[P]2(c1ccccc1)c1ccccc1.S(=O)(=O)([O-])C(F)(F)F
• Title of publication: cis and trans influences on [Pt(SRF)(triphos)]+complexes (SRF= polyfluorobenzothiolate)
• Authors of publication: Cervantes, Ruy; Tiburcio, Jorge; Torrens, Hugo
• Journal of publication: New J. Chem.
• Year of publication: 2015
• Journal volume: 39
• Journal issue: 1
• Pages of publication: 631
• a: 11.1223 ± 0.0004 Å
• b: 13.6579 ± 0.0006 Å
• c: 16.7386 ± 0.0007 Å
• α: 67.229 ± 0.003°
• β: 81.64 ± 0.002°
• γ: 71.075 ± 0.002°
• Cell volume: 2217.22 ± 0.17 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1128
• Residual factor for significantly intense reflections: 0.0866
• Weighted residual factors for significantly intense reflections: 0.2318
• Weighted residual factors for all reflections included in the refinement: 0.2972
• Goodness-of-fit parameter for all reflections included in the refinement: 1.335
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No