Molecular Rearrangement of an Aza-Scorpiand Macrocycle Induced by pH: A Computational Study †

Rearrangements and their control are a hot topic in supramolecular chemistry due to the possibilities that these phenomena open in the design of synthetic receptors and molecular machines. Macrocycle aza-scorpiands constitute an interesting system that can reorganize their spatial structure dependin...

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Bibliographic Details
Main Authors: De Julián-Ortiz, Jesus Vicente, Verdejo, Begoña, Polo, Víctor, Besalú, Emili, García-España, Enrique
Format: Online
Language:English
Published: MDPI 2016
Online Access:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4964504/