Information card for entry 7712109

Structure parameters

• Formula: C41 H59 N2 O2 Sm
• Calculated formula: C41 H59 N2 O2 Sm
• Title of publication: Formation of a cyclooctatetraenylsamarium(III) inverse sandwich that ring-opens tetrahydrofuran.
• Authors of publication: Peedika Paramban, Ramees; Guo, Zhifang; Deacon, Glen B.; Junk, Peter C.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• a: 10.842 ± 0.002 Å
• b: 18.607 ± 0.004 Å
• c: 18.765 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3785.6 ± 1.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.03
• Residual factor for significantly intense reflections: 0.0292
• Weighted residual factors for significantly intense reflections: 0.076
• Weighted residual factors for all reflections included in the refinement: 0.0767
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No