Information card for entry 4115800

Structure parameters

• Chemical name: Catena-poly{tris[tetrakis(μ-trifluoroacetato-κO,κO') dirhodium(II,II)]-bis(μ3-η2(1,2):η2(7,8):η2(9,10)- triphenylene)}
• Formula: C60 H24 F36 O24 Rh6
• Calculated formula: C60 H24 F36 O24 Rh6
• Title of publication: Using Structures Formed by Dirhodium Tetra(trifluoroacetate) with Polycyclic Aromatic Hydrocarbons to Prospect for Maximum π-Electron Density: Hückel Calculations Get It Right
• Authors of publication: F. Albert Cotton; Evgeny V. Dikarev; Marina A. Petrukhina
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2001
• Journal volume: 123
• Pages of publication: 11655 - 11663
• a: 9.42 ± 0.001 Å
• b: 10.215 ± 0.001 Å
• c: 19.648 ± 0.005 Å
• α: 94.99 ± 0.02°
• β: 95.29 ± 0.01°
• γ: 95.05 ± 0.01°
• Cell volume: 1866.6 ± 0.6 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1253
• Residual factor for significantly intense reflections: 0.0866
• Weighted residual factors for all reflections: 0.1965
• Weighted residual factors for significantly intense reflections: 0.1666
• Goodness-of-fit parameter for all reflections: 1.112
• Goodness-of-fit parameter for significantly intense reflections: 1.131
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No