Information card for entry 7060991

Structure parameters

• Formula: C124 H131 Er5 N24 O33
• Calculated formula: C124 H131 Er5 N24 O33
• Title of publication: Radii-dependent self-assembly polynuclear lanthanide complexes as catalysts for CO2 transformation into cyclic carbonates
• Authors of publication: Chen, Changjuan; Zhang, Aijiang
• Journal of publication: New Journal of Chemistry
• Year of publication: 2021
• Journal volume: 45
• Journal issue: 43
• Pages of publication: 20155 - 20163
• a: 35.344 ± 0.0016 Å
• b: 20.8374 ± 0.0014 Å
• c: 21.395 ± 0.0015 Å
• α: 90°
• β: 100.671 ± 0.003°
• γ: 90°
• Cell volume: 15484.4 ± 1.7 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0692
• Residual factor for significantly intense reflections: 0.0545
• Weighted residual factors for significantly intense reflections: 0.1282
• Weighted residual factors for all reflections included in the refinement: 0.1303
• Goodness-of-fit parameter for all reflections included in the refinement: 0.951
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No