Information card for entry 4074135

Structure parameters

• Formula: C46 H47 B2 F24 N P2 Ru
• Calculated formula: C46 H47 B2 F24 N P2 Ru
• Title of publication: Syntheses and Reactivity of Cationic Borane−Ruthenium Complexes [(η5-C5R5)Ru(PMe3)2(η1-BH3·EMe3)][BArf4] (R = H, Me; E = N, P; BArf4= [B{3,5-C6H3(CF3)2}4])
• Authors of publication: Kawano, Yasuro; Hashiva, Masahiro; Shimoi, Mamoru
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 18
• Pages of publication: 4420
• a: 13.281 ± 0.004 Å
• b: 13.699 ± 0.004 Å
• c: 15.245 ± 0.004 Å
• α: 90.169 ± 0.011°
• β: 106.835 ± 0.012°
• γ: 95.719 ± 0.011°
• Cell volume: 2640.1 ± 1.3 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0421
• Residual factor for significantly intense reflections: 0.0348
• Weighted residual factors for significantly intense reflections: 0.1019
• Weighted residual factors for all reflections included in the refinement: 0.111
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No