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Unconventional Stereoerror Formation Mechanisms in Nonmetallocene Propene Polymerization Systems Revealed by DFT Calculations
[Image: see text] An unconventional mechanism for the stereoerror formation in propene polymerization catalyzed by C(1)-symmetric salalen-M systems (M = Zr, Hf) is suggested by DFT calculations. While propagation happens with the ligand in its fac-mer conformation, a change of ligand wrapping mode f...
| Autores principales: | , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2022
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9483984/ https://www.ncbi.nlm.nih.gov/pubmed/36054494 http://dx.doi.org/10.1021/acs.jpca.2c04935 |