Information card for entry 4110848

Structure parameters

• Formula: C160 H200 O8 P8 Pt4
• Calculated formula: C160 H200 O8 P8 Pt4
• SMILES: [P](CC)(CC)(CC)[Pt]1(C#Cc2cc3c(cc2)c(c(OCC)cc3)c2c3ccc(cc3ccc2OCC)C#C[Pt]([P](CC)(CC)CC)([P](CC)(CC)CC)C#Cc2ccc3c(c2)ccc(OCC)c3c2c(OCC)ccc3c2ccc(C#C[Pt](C#Cc2cc4c(cc2)c(c(OCC)cc4)c2c4ccc(cc4ccc2OCC)C#C[Pt]([P](CC)(CC)CC)([P](CC)(CC)CC)C#Cc2ccc4c(c2)ccc(OCC)c4c2c(OCC)ccc4c2ccc(C#C1)c4)([P](CC)(CC)CC)[P](CC)(CC)CC)c3)[P](CC)(CC)CC
• Title of publication: Directed Assembly of Mesoscopic Metallocycles with Controllable Size, Chirality, and Functionality Based on the Robust Pt-Alkynyl Linkage
• Authors of publication: Hua Jiang; Wenbin Lin
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• Journal volume: 128
• Pages of publication: 11286 - 11297
• a: 36.603 ± 0.016 Å
• b: 12.976 ± 0.006 Å
• c: 25.145 ± 0.012 Å
• α: 90°
• β: 126.653 ± 0.009°
• γ: 90°
• Cell volume: 9581 ± 8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.1915
• Residual factor for significantly intense reflections: 0.1402
• Weighted residual factors for significantly intense reflections: 0.3322
• Weighted residual factors for all reflections included in the refinement: 0.3578
• Goodness-of-fit parameter for all reflections included in the refinement: 1.125
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No