Information card for entry 4319546

Structure parameters

• Formula: C92 H92 Ag2 Cl2 O14 P4 Pt2 S4
• Calculated formula: C92 H92 Ag2 Cl2 O14 P4 Pt2 S4
• SMILES: [Ag]1[S]2[Pt]([P](c3ccccc3)(c3ccccc3)c3ccccc3)([P](c3ccccc3)(c3ccccc3)c3ccccc3)[S](C2=C(C(=O)C)C(=O)C)[Ag][S]2[Pt]([P](c3ccccc3)(c3ccccc3)c3ccccc3)([P](c3ccccc3)(c3ccccc3)c3ccccc3)[S]1C2=C(C(=O)C)C(=O)C.Cl(=O)(=O)(=O)[O-].CCOCC.Cl(=O)(=O)(=O)[O-].CCOCC
• Title of publication: Mononuclear (Pd, Pt), Heterodinuclear (PdAg, PtAg), and Tetranuclear (Pd2Ag2, Pt2Ag2) 1,1-Ethylenedithiolato Complexes
• Authors of publication: José Vicente; María Teresa Chicote; Sonia Huertas; Delia Bautista; Peter G. Jones; Axel K. Fischer
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 2051 - 2057
• a: 11.0089 ± 0.0002 Å
• b: 29.4225 ± 0.0005 Å
• c: 14.0317 ± 0.0003 Å
• α: 90°
• β: 100.846 ± 0.01°
• γ: 90°
• Cell volume: 4463.8 ± 0.2 ų
• Cell temperature: 163 ± 2 K
• Ambient diffraction temperature: 163 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0529
• Residual factor for significantly intense reflections: 0.0323
• Weighted residual factors for significantly intense reflections: 0.0524
• Weighted residual factors for all reflections included in the refinement: 0.0572
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No