Information card for entry 7124103

Structure parameters

• Formula: C31 H34 B F5 N2
• Calculated formula: C31 H34 B F5 N2
• Title of publication: Activation of olefin metathesis complexes containing unsymmetrical unsaturated N-heterocyclic carbenes by copper and gold transmetalation
• Authors of publication: Kamal, Fadwa; Colombel-Rouen, Sophie; DUMAS, Adrien; Guegan, Jean Paul; Roisnel, Thierry; Dorcet, Vincent; Basle, Olivier; Rouen, Mathieu; Mauduit, Marc
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 9.3875 ± 0.0017 Å
• b: 19.402 ± 0.003 Å
• c: 15.257 ± 0.004 Å
• α: 90°
• β: 98.302 ± 0.01°
• γ: 90°
• Cell volume: 2749.7 ± 1 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• 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: 0.1244
• Residual factor for significantly intense reflections: 0.0893
• Weighted residual factors for significantly intense reflections: 0.2275
• Weighted residual factors for all reflections included in the refinement: 0.2646
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No