Information card for entry 4312168

Structure parameters

• Common name: ana279
• Formula: C70 H34 F20 P2 Pt3 S2
• Calculated formula: C70 H34 F20 P2 Pt3 S2
• SMILES: [Pt]123[S]([Pt]4([C](#[C]4c4ccccc4)[P]3(c3ccccc3)c3ccccc3)(c3c(c(c(c(c3F)F)F)F)F)c3c(c(c(c(c3F)F)F)F)F)c3c([S]1[Pt]1([C](#[C]1c1ccccc1)[P]2(c1ccccc1)c1ccccc1)(c1c(c(c(c(c1F)F)F)F)F)c1c(c(c(c(c1F)F)F)F)F)cccc3
• Title of publication: Alkynyldiphenylphosphine d8 (Pt, Rh, Ir) Complexes: Contrasting Behavior toward cis-[Pt(C6F5)2(THF)2]
• Authors of publication: Jesús R. Berenguer; María Bernechea; Juan Forniés; Ana García; Elena Lalinde; M. Teresa Moreno
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 8185 - 8198
• a: 15.3996 ± 0.0003 Å
• b: 15.7509 ± 0.0002 Å
• c: 18.5369 ± 0.0004 Å
• α: 107.125 ± 0.001°
• β: 93.346 ± 0.001°
• γ: 109.968 ± 0.001°
• Cell volume: 3974.89 ± 0.13 ų
• Cell temperature: 223 ± 1 K
• Ambient diffraction temperature: 223 ± 1 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: 0.058
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.1134
• Weighted residual factors for all reflections included in the refinement: 0.1252
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No