Information card for entry 4078068

Structure parameters

• Formula: C64 H43 B F10 O0.25 P2 Ru S
• Calculated formula: C64 H43 B F10 O0.25 P2 Ru S
• Title of publication: Ruthenium and Rhodium Complexes of Thioether-Alkynylborates
• Authors of publication: Dahcheh, Fatme; Stephan, Douglas W.
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 8
• Pages of publication: 3222
• a: 41.347 ± 0.004 Å
• b: 41.347 ± 0.004 Å
• c: 13.4355 ± 0.0019 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 22969 ± 5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0716
• Residual factor for significantly intense reflections: 0.0497
• Weighted residual factors for significantly intense reflections: 0.1085
• Weighted residual factors for all reflections included in the refinement: 0.117
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No