Information card for entry 4074133

Structure parameters

• Formula: C46 H47 B2 F24 P3 Ru
• Calculated formula: C46 H47 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: 14.01 ± 0.007 Å
• b: 25.638 ± 0.016 Å
• c: 15.42 ± 0.009 Å
• α: 90°
• β: 94.33 ± 0.03°
• γ: 90°
• Cell volume: 5523 ± 5 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0691
• Residual factor for significantly intense reflections: 0.0486
• Weighted residual factors for all reflections: 0.1494
• Weighted residual factors for significantly intense reflections: 0.138
• Goodness-of-fit parameter for all reflections: 1.009
• Goodness-of-fit parameter for significantly intense reflections: 1.117
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No