Information card for entry 4068704

Structure parameters

• Formula: C60 H78 N4 O2 Y2
• Calculated formula: C60 H78 N4 O2 Y2
• SMILES: c1(c(cccc1C(C)C)C(C)C)N1[Y]23([H][Y]45([H]3)(N(c3c(cccc3C(C)C)C(C)C)C(C)(C)c3[n]5c(ccc3)c3ccccc43)[O]3CCCC3)([n]3c(C1(C)C)cccc3c1ccccc21)[O]1CCCC1
• Title of publication: Selective σ-Bond Metathesis in Alkyl−Aryl and Alkyl−Benzyl Yttrium Complexes. New Aryl− and Benzyl−Hydrido Yttrium Derivatives Supported by Amidopyridinate Ligands
• Authors of publication: Lyubov, D. M.; Fukin, G. K.; Cherkasov, A. V.; Shavyrin, Andrei S.; Trifonov, A. A.; Luconi, L.; Bianchini, C.; Meli, A.; Giambastiani, G.
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 4
• Pages of publication: 1227
• a: 12.9842 ± 0.0003 Å
• b: 12.9842 ± 0.0003 Å
• c: 33.0971 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5579.8 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 92
• Hermann-Mauguin space group symbol: P 41 21 2
• Hall space group symbol: P 4abw 2nw
• Residual factor for all reflections: 0.0301
• Residual factor for significantly intense reflections: 0.0257
• Weighted residual factors for significantly intense reflections: 0.0608
• Weighted residual factors for all reflections included in the refinement: 0.0619
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No