Information card for entry 7061437

Structure parameters

• Formula: C33 H57 N2 O Si2 Y
• Calculated formula: C33 H57 N2 O Si2 Y
• SMILES: [Y]1([O]2CCCC2)([n]2cccc3c2C(N1c1c(cccc1C(C)C)C(C)C)CCC3)(C[Si](C)(C)C)C[Si](C)(C)C
• Title of publication: Amido-trihydroquinoline ligated rare-earth metal complexes for polymerization of isoprene
• Authors of publication: Huo, Yanchen; Hu, Xiang; Wang, Jixing; Hu, Hongfan; Shi, Xiaochao
• Journal of publication: New Journal of Chemistry
• Year of publication: 2022
• Journal volume: 46
• Journal issue: 17
• Pages of publication: 8277 - 8283
• a: 15.925 ± 0.003 Å
• b: 17.322 ± 0.003 Å
• c: 26.711 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7368 ± 2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0659
• Residual factor for significantly intense reflections: 0.0342
• Weighted residual factors for significantly intense reflections: 0.0741
• Weighted residual factors for all reflections included in the refinement: 0.0833
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No