Information card for entry 4084713

Structure parameters

• Formula: C37 H61 B N2 O2 Yb
• Calculated formula: C37 H57 B N2 O2 Yb
• Title of publication: β-Diketiminate Rare Earth Borohydride Complexes: Synthesis, Structure, and Catalytic Activity in the Ring-Opening Polymerization of ε-Caprolactone and Trimethylene Carbonate
• Authors of publication: Schmid, Matthias; Guillaume, Sophie M.; Roesky, Peter W.
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 19
• Pages of publication: 5392
• a: 8.78 ± 0.0003 Å
• b: 12.3442 ± 0.0004 Å
• c: 17.6886 ± 0.0005 Å
• α: 75.7709 ± 0.0025°
• β: 84.403 ± 0.003°
• γ: 85.904 ± 0.003°
• Cell volume: 1847.21 ± 0.1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0414
• Residual factor for significantly intense reflections: 0.0406
• Weighted residual factors for significantly intense reflections: 0.1173
• Weighted residual factors for all reflections included in the refinement: 0.1177
• Goodness-of-fit parameter for all reflections included in the refinement: 1.218
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No