Hemisphere and Distance-Dependent Steric Analysis of PNN Iron Pincer Complexes Using SambVca 2.1 and Its Influence on Alkene Hydrosilylation
| Autor: | Kouta Yujiri, Hidetaka Yuge, Masahiro Kamitani |
|---|---|
| Rok vydání: | 2020 |
| Předmět: |
Steric effects
chemistry.chemical_classification 010405 organic chemistry Hydrosilylation Alkene Astrophysics::High Energy Astrophysical Phenomena Organic Chemistry 010402 general chemistry 01 natural sciences 0104 chemical sciences Pincer movement Inorganic Chemistry chemistry.chemical_compound chemistry Computational chemistry Density functional theory Computational analysis Physical and Theoretical Chemistry |
| Zdroj: | Organometallics. 39:3535-3539 |
| ISSN: | 1520-6041 0276-7333 |
| Popis: | A series of PNN iron pincer complexes was synthesized and structurally characterized by X-ray and computational analysis. Using the optimized structures obtained by density functional theory calcul... |
| Databáze: | OpenAIRE |
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