Information card for entry 4113568

Structure parameters

• Formula: C57 H45 Cl3 O8 P2 Pt S2
• Calculated formula: C57 H45 Cl3 O8 P2 Pt S2
• Title of publication: Ligand Effects on Charge Transport in Platinum(II) Acetylides
• Authors of publication: Terence L. Schull; James G. Kushmerick; Charles H. Patterson; Clifford George; Martin H. Moore; Steven K. Pollack; Ranganathan Shashidhar
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2003
• Journal volume: 125
• Pages of publication: 3202 - 3203
• a: 10.198 ± 0.002 Å
• b: 10.455 ± 0.002 Å
• c: 14.959 ± 0.003 Å
• α: 85.14 ± 0.01°
• β: 82.97 ± 0.01°
• γ: 63.31 ± 0.01°
• Cell volume: 1413.5 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.056
• Residual factor for significantly intense reflections: 0.051
• Weighted residual factors for significantly intense reflections: 0.1283
• Weighted residual factors for all reflections included in the refinement: 0.1327
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No