Information card for entry 4106223

Structure parameters

• Formula: C158 H104 B2 F50 N2 P4 Ru2
• Calculated formula: C158 H104 B2 F50 N2 P4 Ru2
• Title of publication: Probing the Intrinisic Structure and Dynamics of Aminoborane Coordination at Late Transition Metal Centers: Mono(σ-BH) Binding in [CpRu(PR3)2(H2BNCy2)]+
• Authors of publication: Dragoslav Vidovic; David A. Addy; Tobias Krämer; John McGrady; Simon Aldridge
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 8494 - 8497
• a: 13.8216 ± 0.0001 Å
• b: 16.9386 ± 0.0001 Å
• c: 17.6382 ± 0.0002 Å
• α: 61.5593 ± 0.0004°
• β: 86.4334 ± 0.0004°
• γ: 85.0717 ± 0.0004°
• Cell volume: 3616.56 ± 0.05 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.0675
• Residual factor for significantly intense reflections: 0.0489
• Weighted residual factors for all reflections: 0.1204
• Weighted residual factors for significantly intense reflections: 0.1124
• Weighted residual factors for all reflections included in the refinement: 0.1203
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9549
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No