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Computational Studies of Lithium Diisopropylamide Deaggregation
Density functional theory computations [MP2/6–31G(d)//B3LYP/6–31G(d)] on the deaggregation of lithium diisopropylamide (LDA) dimer solvated by two tetrahydrofuran ligands to give the corresponding trisolvated monomer show eight structurally distinct minima. The barriers to exchange are comparable to...
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| Main Authors: | , |
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| Format: | Artigo |
| Sprog: | Inglês |
| Udgivet: |
2011
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| Fag: | |
| Online adgang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3184385/ https://ncbi.nlm.nih.gov/pubmed/21888365 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jo2015642 |
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