Information card for entry 4079133

Structure parameters

• Formula: C88 H74 F12 P6 Ru2
• Calculated formula: C88 H74 F12 P6 Ru2
• Title of publication: Oxidative Dimerization of Aryldiynyl‒Ruthenium Complexes
• Authors of publication: Bruce, Michael I.; Costuas, Karine; Gendron, Frédéric; Halet, Jean-François; Jevric, Martyn; Skelton, Brian W.
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 18
• Pages of publication: 6555
• a: 11.7963 ± 0.0004 Å
• b: 16.7726 ± 0.0009 Å
• c: 20.4211 ± 0.0007 Å
• α: 94.253 ± 0.004°
• β: 105.569 ± 0.003°
• γ: 97.765 ± 0.004°
• Cell volume: 3830.6 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1393
• Residual factor for significantly intense reflections: 0.0799
• Weighted residual factors for significantly intense reflections: 0.2069
• Weighted residual factors for all reflections included in the refinement: 0.233
• Goodness-of-fit parameter for all reflections included in the refinement: 0.959
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No