Information card for entry 4115793

Structure parameters

• Chemical name: Catena-poly{[tetrakis(μ-trifluoroacetato-κO,κO') dirhodium(II,II)](μ-η2(3,4):η2(9,10)-phenanthrene)}
• Formula: C22 H10 F12 O8 Rh2
• Calculated formula: C22 H10 F12 O8 Rh2
• 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: 8.642 ± 0.001 Å
• b: 9.21 ± 0.0007 Å
• c: 17.387 ± 0.003 Å
• α: 75.608 ± 0.004°
• β: 85.458 ± 0.008°
• γ: 81.362 ± 0.005°
• Cell volume: 1324 ± 0.3 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: 0.0547
• Residual factor for significantly intense reflections: 0.0511
• Weighted residual factors for all reflections: 0.153
• Weighted residual factors for significantly intense reflections: 0.1455
• Goodness-of-fit parameter for all reflections: 1.076
• Goodness-of-fit parameter for significantly intense reflections: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No