Information card for entry 7122711

Structure parameters

• Formula: C101 H144 Eu I2 N6 O9
• Calculated formula: C96 H132 Eu I2 N6 O9
• 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: 14.731 ± 0.003 Å
• b: 43.007 ± 0.009 Å
• c: 16.43 ± 0.003 Å
• α: 90°
• β: 92.3 ± 0.03°
• γ: 90°
• Cell volume: 10401 ± 4 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• 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: 0.0441
• Residual factor for significantly intense reflections: 0.0324
• Weighted residual factors for significantly intense reflections: 0.0806
• Weighted residual factors for all reflections included in the refinement: 0.0862
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No