Information card for entry 4074134

Structure parameters

• Formula: C51 H57 B2 F24 P3 Ru
• Calculated formula: C51 H57 B2 F24 P3 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: 12.668 ± 0.003 Å
• b: 12.786 ± 0.003 Å
• c: 37.507 ± 0.006 Å
• α: 90°
• β: 100.204 ± 0.007°
• γ: 90°
• Cell volume: 5979 ± 2 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1036
• Residual factor for significantly intense reflections: 0.0619
• Weighted residual factors for significantly intense reflections: 0.1547
• Weighted residual factors for all reflections included in the refinement: 0.1795
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No