Information card for entry 4068768

Structure parameters

• Formula: C106 H136 O2 P4 Rh2
• Calculated formula: C106 H136 O2 P4 Rh2
• SMILES: [Rh]123([Rh]4([P](=C5C(=C(C5=[P]4c4c(cc(cc4C(C)(C)C)C(C)(C)C)C(C)(C)C)c4ccccc4)c4ccccc4)c4c(cc(cc4C(C)(C)C)C(C)(C)C)C(C)(C)C)(C2=O)C3=O)[P](=C2C(=C(C2=[P]1c1c(cc(cc1C(C)(C)C)C(C)(C)C)C(C)(C)C)c1ccccc1)c1ccccc1)c1c(cc(cc1C(C)(C)C)C(C)(C)C)C(C)(C)C
• Title of publication: Synthesis, Structures, and Reactions of Dirhodium Complexes Bearing a 1,2-Diphenyl-3,4-diphosphinidenecyclobutene Ligand (DPCB)
• Authors of publication: Okazaki, Masaaki; Hayashi, Akito; Fu, Ching-Feng; Liu, Shiuh-Tzung; Ozawa, Fumiyuki
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 3
• Pages of publication: 902
• a: 23.782 ± 0.005 Å
• b: 28.125 ± 0.006 Å
• c: 34.019 ± 0.008 Å
• α: 90°
• β: 110.534 ± 0.003°
• γ: 90°
• Cell volume: 21309 ± 8 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.2073
• Residual factor for significantly intense reflections: 0.17
• Weighted residual factors for significantly intense reflections: 0.3018
• Weighted residual factors for all reflections included in the refinement: 0.3222
• Goodness-of-fit parameter for all reflections included in the refinement: 1.338
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No