CH Mode Mixing Determines the Band Shape of the Carboxylate Symmetric Stretch in Apo-EDTA, Ca2+-EDTA, and Mg2+-EDTA

Mitra, S; Werling, K; Berquist, EJ; Lambrecht, DS; Garrett-Roe, S

Garrett-Roe, S (corresponding author), Univ Pittsburgh, Dept Chem, Pittsburgh, PA 15260 USA.

JOURNAL OF PHYSICAL CHEMISTRY A, 2021; 125 (22): 4867

Abstract

The infrared spectra of EDTA complexed with Ca2+ and Mg2+ contain, to date, unidentified vibrational bands. This study assigns the peaks in the linear......

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