Information card for entry 7037777

Structure parameters

• Formula: C54 H45 B F5 N P2 Ru
• Calculated formula: C54 H45 B F5 N P2 Ru
• Title of publication: Access to novel fluorovinylidene ligands via exploitation of outer-sphere electrophilic fluorination: new insights into C-F bond formation and activation.
• Authors of publication: Milner, Lucy M.; Hall, Lewis M.; Pridmore, Natalie E.; Skeats, Matthew K.; Whitwood, Adrian C.; Lynam, Jason M.; Slattery, John M.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 4
• Pages of publication: 1717 - 1726
• a: 11.6304 ± 0.0005 Å
• b: 13.5851 ± 0.0007 Å
• c: 15.1453 ± 0.0009 Å
• α: 72.589 ± 0.005°
• β: 89.929 ± 0.004°
• γ: 79.01 ± 0.004°
• Cell volume: 2237.5 ± 0.2 ų
• Cell temperature: 109.8 ± 0.6 K
• Ambient diffraction temperature: 109.8 ± 0.6 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: 0.0474
• Residual factor for significantly intense reflections: 0.0355
• Weighted residual factors for significantly intense reflections: 0.0769
• Weighted residual factors for all reflections included in the refinement: 0.0829
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71071 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No