Information card for entry 4310005

Structure parameters

• Formula: C44 H42 O8 P2 Rh2
• Calculated formula: C44 H42 O8 P2 Rh2
• SMILES: [Rh]1234([Rh]([P](c5c4cccc5)(c4ccccc4)c4ccccc4)([O]=C(O2)C)(OC(=[O]3)C)([O]=C(O)C)c2c([P]1(c1ccccc1)c1ccccc1)cccc2)[O]=C(O)C
• Title of publication: Chiral Organometallic Triangles with Rh-Rh Bonds. 2. Compounds Prepared from Enantiopure cis-Rh2(C6H4PPh2)2(OAc)2(HOAc)2 and Their Catalytic Potentials
• Authors of publication: F. Albert Cotton; Carlos A. Murillo; Salah E. Stiriba; Xiaoping Wang; Rongmin Yu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 8223 - 8233
• a: 10.667 ± 0.003 Å
• b: 15.152 ± 0.004 Å
• c: 25.053 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4049.2 ± 1.8 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0198
• Residual factor for significantly intense reflections: 0.0184
• Weighted residual factors for significantly intense reflections: 0.0456
• Weighted residual factors for all reflections included in the refinement: 0.0466
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No