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DFT Study of the Silyl Esters of Thiophosphorus Acids

✍ Scribed by Marek Cypryk; Grzegorz Krasiński


Book ID
107677860
Publisher
Springer Netherlands
Year
2010
Tongue
English
Weight
306 KB
Volume
2
Category
Article
ISSN
1876-990X

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DFT Theoretical Study of the Chemioselec
✍ Gjergji Sini; Moncef Bellassoued; Nancy Brodie 📂 Article 📅 2000 🏛 Elsevier Science 🌐 French ⚖ 369 KB

The different chemioselectivity observed experimentally during the silylation of the title species was investigated by means of theoretical methods. The influence of the solvent on the optimized geometries and relative energies of different reaction intermediate species was studied by applying the c