Information card for entry 4084834

Structure parameters

• Formula: C150.5 H126.5 Cl1.5 F10 N2 O4 P4 Pt2
• Calculated formula: C150.5 H126.5 Cl1.5 F10 N2 O4 P4 Pt2
• Title of publication: Rotaxanes Derived from Dimetallic Polyynediyl Complexes: Extended Axles and Expanded Macrocycles
• Authors of publication: Baranová, Zuzana; Amini, Hashem; Bhuvanesh, Nattamai; Gladysz, John A.
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 23
• Pages of publication: 6746
• a: 12.601 ± 0.003 Å
• b: 20.408 ± 0.004 Å
• c: 26.978 ± 0.005 Å
• α: 92.508 ± 0.003°
• β: 96.172 ± 0.003°
• γ: 107.174 ± 0.003°
• Cell volume: 6569 ± 2 ų
• Cell temperature: 100.15 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0337
• Residual factor for significantly intense reflections: 0.0275
• Weighted residual factors for significantly intense reflections: 0.0595
• Weighted residual factors for all reflections included in the refinement: 0.0617
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation wavelength: 0.6889 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No