Information card for entry 7122710

Structure parameters

• Formula: C68 H96 I2 N4 O10 Yb
• Calculated formula: C68 H96 I2 N4 O10 Yb
• Title of publication: Access to divalent lanthanide NHC complexes by redox-transmetallation from silver and CO2 insertion reactions
• Authors of publication: Simler, Thomas; Feuerstein, Thomas J.; Yadav, Ravi; Gamer, Michael T.; Roesky, Peter W.
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 10.944 ± 0.0008 Å
• b: 11.7197 ± 0.0012 Å
• c: 15.4166 ± 0.0012 Å
• α: 67.716 ± 0.007°
• β: 75.423 ± 0.006°
• γ: 78.241 ± 0.007°
• Cell volume: 1757.8 ± 0.3 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.0377
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.0803
• Weighted residual factors for all reflections included in the refinement: 0.0824
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No