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Updated: Mar 17, 2026

Preparation of Stable Bicyclic Aziridinium Ions and Their Ring-Opening for the Synthesis of Azaheterocycles
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Molecular Rearrangement of an Aza-Scorpiand Macrocycle Induced by pH: A Computational Study

Jesus Vicente De Julián-Ortiz1,2, Begoña Verdejo3, Víctor Polo4

  • 1ProtoQSAR SL, Parc Científic, 46980 Paterna, València, Spain. jejuor@uv.es.

International Journal of Molecular Sciences
|July 19, 2016
PubMed

Keywords:
Density Functional TheoryMonte Carlo Multiple Minimumaza-scorpiandspH controlledsemi-empiricalsupramolecular chemistrysynthetic receptors

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