Information card for entry 4345759

Structure parameters

• Formula: C76 H61 Ag2 Cl2 F6 N0 O4 P5 Pt
• Calculated formula: C76 H61 Ag2 Cl2 F6 O4 P5 Pt
• SMILES: [Pt]123([Ag]4([Cl][Ag]([P](c5ccccc5)(c5ccccc5)c5ccccc5)[C]3#Cc3ccc(cc3)C(F)(F)F)[P](C[P]1(CC[P]2(C[P]4(c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)C#Cc1ccc(cc1)C(F)(F)F.Cl(=O)(=O)(=O)[O-]
• Title of publication: Photophysical and Electroluminescent Properties of PtAg2 Acetylide Complexes Supported with meso- and rac-Tetraphosphine.
• Authors of publication: Shu, Hui-Xing; Wang, Jin-Yun; Zhang, Qian-Chong; Chen, Zhong-Ning
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• Journal volume: 56
• Journal issue: 16
• Pages of publication: 9461 - 9473
• a: 13.92 ± 0.002 Å
• b: 14.806 ± 0.002 Å
• c: 20.58 ± 0.004 Å
• α: 109.113 ± 0.007°
• β: 95.588 ± 0.009°
• γ: 112.005 ± 0.007°
• Cell volume: 3596.6 ± 1.1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0621
• Residual factor for significantly intense reflections: 0.0487
• Weighted residual factors for significantly intense reflections: 0.1093
• Weighted residual factors for all reflections included in the refinement: 0.1321
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No