Information card for entry 4084257

Structure parameters

• Formula: C32 H36 B F4 O4 Ru
• Calculated formula: C32 H36 B F4 O4 Ru
• SMILES: [Ru](c1c(cc(OC)cc1)C)(c1c(cc(OC)cc1)C)(c1c(cc(OC)cc1)C)c1c(cc(OC)cc1)C.[B](F)(F)(F)[F-]
• Title of publication: Migratory Insertion and Reductive Coupling of Tetraarylruthenium(IV) Complexes
• Authors of publication: So, Shiu-Chun; Cheung, Wai-Man; Wang, Guo-Cang; Kwan Huang, Enrique; Lau, Man-Kit; Zhang, Qian-Feng; Sung, Herman H.-Y.; Williams, Ian D.; Leung, Wa-Hung
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 17
• Pages of publication: 4497
• a: 10.64068 ± 0.00016 Å
• b: 13.8089 ± 0.0002 Å
• c: 20.4693 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3007.68 ± 0.08 ų
• Cell temperature: 99.98 ± 0.1 K
• Ambient diffraction temperature: 99.98 ± 0.1 K
• Number of distinct elements: 6
• 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: 0.025
• Residual factor for significantly intense reflections: 0.0238
• Weighted residual factors for significantly intense reflections: 0.0586
• Weighted residual factors for all reflections included in the refinement: 0.0593
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No