Information card for entry 7220739

Structure parameters

• Formula: C46 H78 N5 O2 Yb
• Calculated formula: C46 H78 N5 O2 Yb
• SMILES: [Yb]1234(Oc5c(cc(cc5C[N]2(Cc2c(O1)c(cc(c2)C(C)(C)C)C(C)(C)C)CC[N]3(C)C)C(C)(C)C)C(C)(C)C)[N](=C(N4C(C)C)N1CCCCC1)C(C)C
• Title of publication: Synthesis and characterization of rare-earth metal guanidinates stabilized by amine-bridged bis(phenolate) ligands and their application in the controlled polymerization of rac-lactide and rac-β-butyrolactone
• Authors of publication: Zeng, Tinghua; Qian, Qinqin; Zhao, Bei; Yuan, Dan; Yao, Yingming; Shen, Qi
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 11.228 ± 0.0007 Å
• b: 11.8377 ± 0.0007 Å
• c: 20.1349 ± 0.0018 Å
• α: 86.23 ± 0.007°
• β: 82.991 ± 0.007°
• γ: 64.118 ± 0.004°
• Cell volume: 2389.5 ± 0.3 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: 0.061
• Residual factor for significantly intense reflections: 0.0529
• Weighted residual factors for significantly intense reflections: 0.0992
• Weighted residual factors for all reflections included in the refinement: 0.1042
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No