Information card for entry 7711416

Structure parameters

• Formula: C39 H65 N4 O Si Y
• Calculated formula: C39 H65 N4 O Si Y
• SMILES: [Y]12(Nc3c(C(C)C)cccc3C(C)C)([N](=C(C=C(N2CC[N]13CCOCC3)C)C)c1c(C(C)C)cccc1C(C)C)C[Si](C)(C)C
• Title of publication: Synthesis of rare-earth metal complexes with a morpholine-functionalized β-diketiminato ligand and their catalytic activities towards C-O and C-N bond formation.
• Authors of publication: Zhu, Xiancui; He, Jinqiang; Yang, Yuanqing; Zhou, Shuangliu; Wei, Yun; Wang, Shaowu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2022
• Journal volume: 51
• Journal issue: 35
• Pages of publication: 13227 - 13235
• a: 11.1438 ± 0.0011 Å
• b: 11.2147 ± 0.0012 Å
• c: 21.504 ± 0.002 Å
• α: 86.101 ± 0.002°
• β: 84.965 ± 0.002°
• γ: 69.876 ± 0.001°
• Cell volume: 2511.6 ± 0.4 ų
• Cell temperature: 293.15 K
• Ambient diffraction temperature: 293.15 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1242
• Residual factor for significantly intense reflections: 0.0722
• Weighted residual factors for significantly intense reflections: 0.183
• Weighted residual factors for all reflections included in the refinement: 0.2091
• Goodness-of-fit parameter for all reflections included in the refinement: 0.964
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No