Scope of the 2(5H)-furanone helicity rule: a combined ECD, VCD, and DFT investigation

Author:

M. dos Santos Jr. Fernando1234,Bicalho Keylla U.5674,Calisto Ítalo H.1234,S. Scatena Gabriel1234,Fernandes João B.1234,Cass Quezia B.1234ORCID,Batista Jr. João M.12348ORCID

Affiliation:

1. Department of Chemistry

2. Federal University of São Carlos – UFSCar

3. São Carlos

4. Brazil

5. Institute of Chemistry

6. São Paulo State University – UNESP

7. Araraquara

8. Institute of Science and Technology

Abstract

Combination of ECD, VCD and DFT calculations revealed a possible exception to the widely used helicity rule of the 2(5H)-furanone chromophore.

Funder

Fundação de Amparo à Pesquisa do Estado de São Paulo

Publisher

Royal Society of Chemistry (RSC)

Subject

Organic Chemistry,Physical and Theoretical Chemistry,Biochemistry

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