Stereoisomerization during Molecular Packing.

molecular design molecular packing solid-state materials stereoisomerization

Journal

Advanced materials (Deerfield Beach, Fla.)
ISSN: 1521-4095
Titre abrégé: Adv Mater
Pays: Germany
ID NLM: 9885358

Informations de publication

Date de publication:
Jun 2021
Historique:
revised: 03 03 2021
received: 04 02 2021
pubmed: 30 4 2021
medline: 30 4 2021
entrez: 29 4 2021
Statut: ppublish

Résumé

Isomerization is an essential chemical process that often evokes dramatic change of chemical, physical, or biological properties. For a long time, isomerization has been known as a transformation that is induced by certain external energy such as light, heat, or mechanical force. Herein, a new isomerization phenomenon is described, which does not require external energy but simply occurs during molecular packing. The proposed isomerization is demonstrated by a series of symmetric donor-acceptor-donor (D-A-D) molecules, the donor of which may adopt two different stereoisomeric forms. Based on the evidence of the asymmetric isomers in crystals, the occurrence of isomerization during molecular packing is proved. Moreover, the unique asymmetric geometry in the solid state favors the restriction of intramolecular motion, resulting in highly efficient organic solids with quantum yields approaching unity.

Identifiants

pubmed: 33914374
doi: 10.1002/adma.202100986
doi:

Types de publication

Journal Article

Langues

eng

Sous-ensembles de citation

IM

Pagination

e2100986

Subventions

Organisme : Singapore National Research Foundation
ID : R279-000-444-281
Organisme : Singapore National Research Foundation
ID : R279-000-483-281
Organisme : National University of Singapore
ID : R279-000-482-133
Organisme : National Supercomputing Centre, Singapore

Informations de copyright

© 2021 Wiley-VCH GmbH.

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CCDC 1527590 and 1846159 contain the crystallographic data for compound 3 and 4. These data can be obtained free of charge from The Cambridge Crystallographic Data Centre.

Auteurs

Shidang Xu (S)

Department of Chemical and Biomolecular Engineering, National University of Singapore, 4 Engineering Drive 4, Singapore, 117585, Singapore.

Yukun Duan (Y)

Department of Chemical and Biomolecular Engineering, National University of Singapore, 4 Engineering Drive 4, Singapore, 117585, Singapore.

Purnima Manghnani (P)

Department of Chemical and Biomolecular Engineering, National University of Singapore, 4 Engineering Drive 4, Singapore, 117585, Singapore.
Department of Chemical and Biomolecular Engineering, National University of Singapore, 4 Engineering Drive 4, Singapore, 117585, Singapore.

Chengjian Chen (C)

Department of Chemical and Biomolecular Engineering, National University of Singapore, 4 Engineering Drive 4, Singapore, 117585, Singapore.

Sergey M Kozlov (SM)

Department of Chemical and Biomolecular Engineering, National University of Singapore, 4 Engineering Drive 4, Singapore, 117585, Singapore.

Bin Liu (B)

Department of Chemical and Biomolecular Engineering, National University of Singapore, 4 Engineering Drive 4, Singapore, 117585, Singapore.
Joint School of National University of Singapore and Tianjin University, International Campus of Tianjin University, Binhai New City, Fuzhou, 350207, China.

Classifications MeSH