Information card for entry 4080702

Structure parameters

• Formula: C43 H76 N3 Nd O3 Si2
• Calculated formula: C43 H76 N3 Nd O3 Si2
• SMILES: [Nd]123(Oc4c(cc(cc4C=[N]2CC[N]3(Cc2c(O1)c(cc(c2)C(C)(C)C)C(C)(C)C)C)[C](C)([CH3])C)C(C)(C)C)([O]1CCCC1)N([Si](C)(C)C)[Si](C)(C)C
• Title of publication: Synthesis and Characterization of Salalen Lanthanide Complexes and Their Application in the Polymerization ofrac-Lactide
• Authors of publication: Nie, Kun; Gu, Weikai; Yao, Yingming; Zhang, Yong; Shen, Qi
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 9
• Pages of publication: 2608
• a: 13.766 ± 0.006 Å
• b: 13.982 ± 0.005 Å
• c: 15.195 ± 0.006 Å
• α: 98.765 ± 0.004°
• β: 107.678 ± 0.004°
• γ: 113.817 ± 0.006°
• Cell volume: 2419.1 ± 1.7 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 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: 0.0784
• Residual factor for significantly intense reflections: 0.0554
• Weighted residual factors for significantly intense reflections: 0.1246
• Weighted residual factors for all reflections included in the refinement: 0.1641
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No