Vibrational Circular Dichroism (VCD) Reveals Subtle Conformational Aspects and Intermolecular Interactions in the Carnitine Family.

Abstract:

:Vibrational circular dichroism spectra (VCD) in the mid-IR region and electronic circular dichroism (ECD) spectra for three carnitine derivatives in the form of hydrochloride salts were recorded in deuterated methanol solutions. Density Functional Theory calculations help one to understand the significance of the observed VCD bands. VCD and ECD spectra are informative about the absolute configuration of the molecule, but VCD data reveal also some conformational aspects in the N,N,N-trimethyl moiety and inform us about intermolecular interactions gained from the carbonyl stretching region for the acyl substituted carnitines.

journal_name

Chirality

journal_title

Chirality

authors

Mazzeo G,Abbate S,Longhi G,Castiglioni E,Villani C

doi

10.1002/chir.22532

subject

Has Abstract

pub_date

2015-12-01 00:00:00

pages

907-13

issue

12

eissn

0899-0042

issn

1520-636X

journal_volume

27

pub_type

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