Information card for entry 4078018

Structure parameters

• Formula: C106 H142 N4 Nd2 O4
• Calculated formula: C106 H142 N4 Nd2 O4
• SMILES: c1(c(cccc1C)C)[NH]1[Nd]23(N(Cc4cc(C(C)(C)C)cc(c4[O]2[Nd]24([NH](Cc5c(c(cc(c5)C(C)(C)C)C(C)(C)C)O2)c2c(cccc2C)C)N(Cc2c([O]34)c(cc(c2)C(C)(C)C)C(C)(C)C)c2c(cccc2C)C)C(C)(C)C)c2c(cccc2C)C)Oc2c(cc(cc2C1)C(C)(C)C)C(C)(C)C.c1(ccccc1)C.c1(ccccc1)C
• Title of publication: Synthesis and Characterization of Lanthanide Amides Bearing Aminophenoxy Ligands and Their Catalytic Activity for the Polymerization of Lactides
• Authors of publication: Zhang, Jie; Qiu, Jinshui; Yao, Yingming; Zhang, Yong; Wang, Yaorong; Shen, Qi
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 8
• Pages of publication: 3138
• a: 11.9744 ± 0.001 Å
• b: 13.1231 ± 0.0011 Å
• c: 15.3787 ± 0.0014 Å
• α: 88.044 ± 0.005°
• β: 82.648 ± 0.005°
• γ: 88.124 ± 0.005°
• Cell volume: 2394.4 ± 0.4 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0763
• Residual factor for significantly intense reflections: 0.0637
• Weighted residual factors for significantly intense reflections: 0.1416
• Weighted residual factors for all reflections included in the refinement: 0.1493
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No