Information card for entry 4114813

Structure parameters

• Chemical name: tetrakis(m^2-2,4,6-triisopropylbenzoato-O,O')dirhodium(II,II), acetone solvate
• Formula: C72.67 H109.44 O10.9 Rh2
• Calculated formula: C72.672 H109.448 O10.908 Rh2
• Title of publication: The First Dirhodium Tetracarboxylate Molecule without Axial Ligation: New Insight into the Electronic Structures of Molecules with Importance in Catalysis and Other Reactions
• Authors of publication: F. Albert Cotton; Elizabeth A. Hillard; Carlos A. Murillo
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2002
• Journal volume: 124
• Pages of publication: 5658 - 5660
• a: 14.776 ± 0.0012 Å
• b: 16.429 ± 0.0014 Å
• c: 17.4638 ± 0.0015 Å
• α: 65.457 ± 0.001°
• β: 78.709 ± 0.002°
• γ: 87.445 ± 0.002°
• Cell volume: 3778.5 ± 0.6 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0684
• Residual factor for significantly intense reflections: 0.0519
• Weighted residual factors for significantly intense reflections: 0.1337
• Weighted residual factors for all reflections included in the refinement: 0.1472
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No