Information card for entry 4334652

Structure parameters

• Formula: C84 H80 Ag2 Cl6 O12 P6 Pt
• Calculated formula: C84 H76 Ag2 Cl6 O12 P6 Pt
• SMILES: c1(ccccc1)[P]1(c2ccccc2)[Ag]2[P](c3ccccc3)(c3ccccc3)C[P]3([Pt]42(C#Cc2ccc(OC)cc2)([P](C1)(C[P]([Ag]4[P](C3)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1)C#Cc1ccc(OC)cc1)c1ccccc1.[O-]Cl(=O)(=O)=O.O.C(Cl)Cl.[O-]Cl(=O)(=O)=O.O.C(Cl)Cl
• Title of publication: Spectroscopic and Phosphorescent Modulation in Triphosphine-Supported PtAg2 Heterotrinuclear Alkynyl Complexes
• Authors of publication: Li-Yi Zhang; Liang-Jin Xu; Xu Zhang; Jin-Yun Wang; Jia Li; Zhong-Ning Chen
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 5167 - 5175
• a: 12.257 ± 0.005 Å
• b: 19.503 ± 0.009 Å
• c: 19.168 ± 0.009 Å
• α: 90°
• β: 95.843 ± 0.013°
• γ: 90°
• Cell volume: 4558 ± 4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.0645
• Residual factor for significantly intense reflections: 0.0522
• Weighted residual factors for significantly intense reflections: 0.1576
• Weighted residual factors for all reflections included in the refinement: 0.1866
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No