Information card for entry 7047473

Structure parameters

• Formula: C47 H82 Lu2 O2
• Calculated formula: C47 H82 Lu2 O2
• Title of publication: Synthesis and molecular structure of pentadienyl complexes of the rare-earth metals.
• Authors of publication: Raeder, Jan; Reiners, Matthias; Baumgarten, Robert; Münster, Katharina; Baabe, Dirk; Freytag, Matthias; Jones, Peter G.; Walter, Marc D.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 41
• Pages of publication: 14468 - 14482
• a: 10.0804 ± 0.0003 Å
• b: 20.1583 ± 0.0006 Å
• c: 22.4603 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4564 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• 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: 0.0393
• Residual factor for significantly intense reflections: 0.0329
• Weighted residual factors for significantly intense reflections: 0.0752
• Weighted residual factors for all reflections included in the refinement: 0.0787
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No