Information card for entry 7110770

Structure parameters

• Common name: {bis(acetonitrile) 1,1'-bis[(S)-(1,1'-binaphthalene-2,2'-dioxy)phosphinoxy)] -3,3',5,5'-tetra-tert-butyl-2,2'-biphenyl}copper(I) triflate
• Formula: C73 H70 Cu F3 N2 O9 P2 S
• Calculated formula: C73 H67 Cu F3 N2 O9 P2 S
• Title of publication: Conjugate addition of diethylzinc to α,β-unsaturated lactones catalyzed by copper‒phosphite complexes
• Authors of publication: Yan, Ming; Zhou, Zhong-Yuan; Chan, Albert S. C.
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 2
• Pages of publication: 115
• a: 17.518 ± 0.004 Å
• b: 17.524 ± 0.004 Å
• c: 27.033 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8299 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.2114
• Residual factor for significantly intense reflections: 0.0623
• Weighted residual factors for significantly intense reflections: 0.1684
• Weighted residual factors for all reflections included in the refinement: 0.2177
• Goodness-of-fit parameter for all reflections included in the refinement: 0.893
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No