MAS NMR Investigation of Molecular Order in an Ionic Liquid Crystal.

ABSTRACT: The structure and molecular order in the thermotropic ionic liquid crystal (ILC), [choline][geranate(H)octanoate], an analogue of Choline And GEranate (CAGE), which has potential for use as a broad-spectrum antimicrobial and transdermal and oral delivery agent, were investigated by magic-angle spinning (MAS) nuclear magnetic resonance (NMR), polarizing optical microscopy, small-angle X-ray scattering (SAXS), and mass spectrometry. Mass spectrometry and the ¹H NMR chemical shift reveal that CAGE-oct is a dynamic system, with metathesis (the exchange of interacting ions) and hydrogen exchange occurring between hydrogen-bonded/ionic complexes such as [(choline)(geranate)(H)(octanoate)], [(choline)(octanoate)₂(H)], and [(choline)(geranate)₂(H)]. These clusters,

SUBMITTER: Mann SK 

PROVIDER: S-EPMC7341529 | biostudies-literature | 2020 Jun

REPOSITORIES: biostudies-literature