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Unidirectional Rotary Motion in Isotopically Chiral Molecular Motors: A Computational Analysis
Linköping University, Sweden;Univ Girona, Spain.ORCID iD: 0000-0003-0222-6380
Linnaeus University, Faculty of Health and Life Sciences, Department of Chemistry and Biomedical Sciences.ORCID iD: 0000-0002-4199-2750
Linköping University, Sweden.ORCID iD: 0000-0001-5847-1196
2020 (English)In: Organic Letters, ISSN 1523-7060, E-ISSN 1523-7052, Vol. 22, no 18, p. 7113-7117Article in journal (Refereed) Published
Abstract [en]

Molecular dynamics simulations are performed to explore if isotopic chirality can induce unidirectional rotary motion in molecular motors operated through double-bond photoisomerizations. Using a highquantum yield motor featuring a chemically asymmetric carbon atom as reference, it is found that isotopically chiral counterparts of this motor sustain such motion almost equally well. Overall, the study reveals a previously unexplored role for isotopic chirality in the design of rotary molecular motors.

Place, publisher, year, edition, pages
American Chemical Society (ACS), 2020. Vol. 22, no 18, p. 7113-7117
National Category
Biochemistry and Molecular Biology Biophysics
Research subject
Chemistry, Biochemistry
Identifiers
URN: urn:nbn:se:lnu:diva-98626DOI: 10.1021/acs.orglett.0c02436ISI: 000574921100013PubMedID: 32822192Scopus ID: 2-s2.0-85090481448OAI: oai:DiVA.org:lnu-98626DiVA, id: diva2:1478966
Available from: 2020-10-23 Created: 2020-10-23 Last updated: 2022-09-02Bibliographically approved

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Oruganti, Baswanth

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