Information card for entry 4109613

Structure parameters

• Formula: C112 H120 F10 P4 Pt2
• Calculated formula: C112 H120 F10 P4 Pt2
• SMILES: C1#CC#CC#CC#CC#CC#C[Pt]2([P](c3ccccc3)(c3ccccc3)CCCCCCCCCCCCCCCCCCCC[P](c3ccccc3)(c3ccccc3)[Pt]1([P](c1ccccc1)(c1ccccc1)CCCCCCCCCCCCCCCCCCCC[P]2(c1ccccc1)c1ccccc1)c1c(c(c(c(c1F)F)F)F)F)c1c(c(c(c(c1F)F)F)F)F
• Title of publication: sp Carbon Chains Surrounded by sp3 Carbon Double Helices: Directed Syntheses of Wirelike Pt(C\τbC)nPt Moieties That Are Spanned by Two P(CH2)mP Linkages via Alkene Metathesis
• Authors of publication: Laura de Quadras; Eike B. Bauer; Wolfgang Mohr; James C. Bohling; Thomas B. Peters; José Miguel Martín-Alvarez; Frank Hampel; John A. Gladysz
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2007
• Journal volume: 129
• Pages of publication: 8296 - 8309
• a: 11.802 ± 0.0003 Å
• b: 16.751 ± 0.0003 Å
• c: 25.733 ± 0.0004 Å
• α: 90°
• β: 91.186 ± 0.0012°
• γ: 90°
• Cell volume: 5086.2 ± 0.18 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• 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: 0.0813
• Residual factor for significantly intense reflections: 0.0492
• Weighted residual factors for significantly intense reflections: 0.1187
• Weighted residual factors for all reflections included in the refinement: 0.1344
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No