Information card for entry 7133324

Structure parameters

• Formula: C80 H84 Ce K O8
• Calculated formula: C80 H84 Ce K O8
• Title of publication: Tetraphenylpentalenide organolanthanide complexes.
• Authors of publication: Katzer, Nicholas J.; Kaur, Mandeep; Sen, Asmita; Nimaiyar, Rupal; Autschbach, Jochen; Arnold, Polly L.; Hintermair, Ulrich
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 72
• Pages of publication: 9749 - 9752
• a: 15.8469 ± 0.0001 Å
• b: 10.1787 ± 0.0001 Å
• c: 21.4308 ± 0.0002 Å
• α: 90°
• β: 94.056 ± 0.001°
• γ: 90°
• Cell volume: 3448.15 ± 0.05 ų
• Cell temperature: 100 ± 0.11 K
• Ambient diffraction temperature: 100 ± 0.11 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0348
• Residual factor for significantly intense reflections: 0.0334
• Weighted residual factors for significantly intense reflections: 0.0796
• Weighted residual factors for all reflections included in the refinement: 0.0803
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No