Information card for entry 4085017

Structure parameters

• Formula: C32 H52 N3 S Si2 Yb
• Calculated formula: C32 H52 N3 S Si2 Yb
• SMILES: [Yb]12([n]3cc(sc3c3[n]1c(ccc3)C(N2c1c(cccc1C(C)C)C(C)C)(C)C)C)(C[Si](C)(C)C)C[Si](C)(C)C
• Title of publication: Organolanthanide Complexes Supported by Thiazole-Containing Amidopyridinate Ligands: Synthesis, Characterization, and Catalytic Activity in Isoprene Polymerization
• Authors of publication: Luconi, Lapo; Lyubov, Dmitrii M.; Rossin, Andrea; Glukhova, Tatyana A.; Cherkasov, Anton V.; Tuci, Giulia; Fukin, Georgy K.; Trifonov, Alexander A.; Giambastiani, Giuliano
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 24
• Pages of publication: 7125
• a: 9.36372 ± 0.00012 Å
• b: 11.5421 ± 0.00014 Å
• c: 16.75309 ± 0.00018 Å
• α: 90°
• β: 92.1653 ± 0.0011°
• γ: 90°
• Cell volume: 1809.33 ± 0.04 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 n 1
• Hall space group symbol: P -2yac
• Residual factor for all reflections: 0.0242
• Residual factor for significantly intense reflections: 0.0214
• Weighted residual factors for significantly intense reflections: 0.0421
• Weighted residual factors for all reflections included in the refinement: 0.0429
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No