Vibrational and electronic circular dichroism of Δ-TRISPHAT [tris(tetrachlorobenzenediolato)phosphate(V)] anion

Bas, Delphine; Buergi, Thomas; Lacour, Jérôme; Vachon, Jérôme; Weber, Jacques

doi:10.1002/chir.20131

Scientific article

English

Vibrational and electronic circular dichroism of Δ-TRISPHAT [tris(tetrachlorobenzenediolato)phosphate(V)] anion

ContributorsBas, Delphine; Buergi, Thomas; Lacour, Jérôme

; Vachon, Jérôme; Weber, Jacques

Published inChirality, vol. 17, no. S1, p. 143-148

Publication date2005

Abstract

Herein is reported an experimental and theoretical study of the circular dichroism properties of TRISPHAT (1) anion. ECD analysis of the [tetramethylammonium][-1] salt confirms the absolute configuration assignment obtained through X-ray crystallographic analysis of the parent cinchonidium salt. The structure, infrared, and vibrational circular dichroism (VCD) spectra derived from density functional theory (DFT) calculations are compared with experimental data.

Keywords

X-ray crystallography
CD properties
DFT
VCD

Affiliation entities

Research groups

Groupe Weber

Citation (ISO format)

BAS, Delphine et al. Vibrational and electronic circular dichroism of Δ-TRISPHAT [tris(tetrachlorobenzenediolato)phosphate(V)] anion. In: Chirality, 2005, vol. 17, n° S1, p. 143–148. doi: 10.1002/chir.20131

Article (Published version)

Identifiers

PID : unige:3628
DOI : 10.1002/chir.20131
PMID : 15806572

Journal ISSN1092-3276

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Vibrational and electronic circular dichroism of Δ-TRISPHAT [tris(tetrachlorobenzenediolato)phosphate(V)] anion

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