Information card for entry 4073104

Structure parameters

• Formula: C46 H59 N4 Yb
• Calculated formula: C46 H59 N4 Yb
• SMILES: [Yb]123456([N](c7c(cccc7C(C)C)C(C)C)=Cc7[n]2cccc7)([N](c2c(cccc2C(C)C)C(C)C)=Cc2[n]1cccc2)[c]1([c]3([c]4([c]5([c]61C)C)C)C)C
• Title of publication: Steric Manipulation of the Reductive Reactivity of Ytterbocenes toward 2-(((2,6-Diisopropylphenyl)imino)methyl)pyridine: Insertion of the NC Bond into the Yb−Indenyl Bond or Oxidative Cleavage of the η5Yb−Cp (Cp = C13H9, Cp*) Bond
• Authors of publication: Trifonov, Alexander A.; Fedorova, Elena A.; Borovkov, Ivan A.; Fukin, Georgy K.; Baranov, Evguenii V.; Larionova, Joulia; Druzhkov, Nikolai O.
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 10
• Pages of publication: 2488
• a: 10.8712 ± 0.0005 Å
• b: 11.5312 ± 0.0005 Å
• c: 17.6163 ± 0.0008 Å
• α: 74 ± 0.001°
• β: 82.13 ± 0.001°
• γ: 71.873 ± 0.001°
• Cell volume: 2014.27 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0356
• Residual factor for significantly intense reflections: 0.0299
• Weighted residual factors for significantly intense reflections: 0.0701
• Weighted residual factors for all reflections included in the refinement: 0.0723
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No