Molecular dynamics and NMR reveal the coexistence of H-bond-assisted and through-space <i>J</i><sub>FH</sub> coupling in fluorinated amino alcohols-Reference-Cited by-同舟云学术

Molecular dynamics and NMR reveal the coexistence of H-bond-assisted and through-space J_FH coupling in fluorinated amino alcohols

Published:2024 Issue:13 Volume:22 Page:2580-2595
ISSN:1477-0520
Container-title:Organic & Biomolecular Chemistry
language:en
Short-container-title:Org. Biomol. Chem.

Author:

Chiari Cassia¹^ORCID,Batista Patrick R.¹^ORCID,Viesser Renan V.²^ORCID,Schenberg Leonardo A.³,Ducati Lucas C.³^ORCID,Linclau Bruno⁴,Tormena Cláudio F.¹^ORCID

Affiliation:

1. Institute of Chemistry, University of Campinas – UNICAMP, P. O. Box 6154, 13083-970, Campinas, São Paulo, Brazil

2. Department of Chemistry, University of Houston, Houston, TX 77024, USA

3. Department of Fundamental Chemistry, Institute of Chemistry, University of São Paulo, Av. Prof. Lineu Prestes, 748, 05508-000, São Paulo, SP, Brazil

4. Department of Organic and Macromolecular Chemistry, Ghent University, Ghent 9000, Belgium

Abstract

The JFH coupling constants in fluorinated amino alcohols were investigated through experimental and theoretical approaches.

Funder

Fundação de Amparo à Pesquisa do Estado de São Paulo

Conselho Nacional de Desenvolvimento Científico e Tecnológico

Coordenação de Aperfeiçoamento de Pessoal de Nível Superior

Publisher

Royal Society of Chemistry (RSC)

Link

http://pubs.rsc.org/en/content/articlepdf/2024/OB/D4OB00049H

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