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An n→π(*) Interaction in Aspirin: Implications for Structure and Reactivity

Stereoelectronic effects modulate molecular structure, reactivity, and conformation. We find that the interaction between the ester and carboxyl moieties of aspirin has a previously unappreciated quantum mechanical character that arises from the delocalization of an electron pair (n) of a donor grou...

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書誌詳細
主要な著者: Choudhary, Amit, Kamer, Kimberli J., Raines, Ronald T.
フォーマット: Artigo
言語:Inglês
出版事項: 2011
主題:
オンライン・アクセス:https://ncbi.nlm.nih.gov/pmc/articles/PMC3184772/
https://ncbi.nlm.nih.gov/pubmed/21842865
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jo201389d
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