Information card for entry 7047479

Structure parameters

• Formula: C30 H54 O Yb
• Calculated formula: C30 H54 O Yb
• 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: 9.8991 ± 0.0002 Å
• b: 21.6891 ± 0.0003 Å
• c: 14.3974 ± 0.0003 Å
• α: 90°
• β: 105.345 ± 0.002°
• γ: 90°
• Cell volume: 2980.96 ± 0.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• 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: 0.0337
• Residual factor for significantly intense reflections: 0.0269
• Weighted residual factors for significantly intense reflections: 0.0555
• Weighted residual factors for all reflections included in the refinement: 0.0577
• Goodness-of-fit parameter for all reflections included in the refinement: 1.125
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No