Twisted Nanographenes with Robust Conformational Stability

Owing to a lack of methodology for rationally and selectively synthesizing twisted nanographenes, it is usually inevitable that we obtain nanographenes as a mixture with various geometries, such as unidirectionally twisted, alternatively twisted, randomly twisted, and even wavy structures, reflectin...

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Main Authors: Penghui Song, Yoshifumi Hashikawa, Chaolumen
Format: Article
Language:English
Published: MDPI AG 2024-10-01
Series:Nanomaterials
Subjects:
Online Access:https://www.mdpi.com/2079-4991/14/21/1737
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author Penghui Song
Yoshifumi Hashikawa
Chaolumen
author_facet Penghui Song
Yoshifumi Hashikawa
Chaolumen
author_sort Penghui Song
collection DOAJ
description Owing to a lack of methodology for rationally and selectively synthesizing twisted nanographenes, it is usually inevitable that we obtain nanographenes as a mixture with various geometries, such as unidirectionally twisted, alternatively twisted, randomly twisted, and even wavy structures, reflecting the high activation barriers among them. Otherwise, they are interconvertible if the barriers are low enough such that only averaged properties can be observed under a thermal equilibrium. Recently, we reported on a double-twisted nanographene containing four [6]helicene units within the skeleton. In this paper, we discuss the robust conformational stability of the nanographene, both experimentally and computationally. The results indicate that the nanographene could only be racemized at temperatures exceeding 200 °C, and the first flip of one of the four [6]helicene units is the rate-degerming step.
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institution Kabale University
issn 2079-4991
language English
publishDate 2024-10-01
publisher MDPI AG
record_format Article
series Nanomaterials
spelling doaj-art-0addb343fdcd45f8b371f52587ff56792024-11-08T14:38:53ZengMDPI AGNanomaterials2079-49912024-10-011421173710.3390/nano14211737Twisted Nanographenes with Robust Conformational StabilityPenghui Song0Yoshifumi Hashikawa1Chaolumen2College of Chemistry and Chemical Engineering, Inner Mongolia University, Hohhot 010021, ChinaInstitute for Chemical Research, Kyoto University, Uji 611-0011, Kyoto, JapanCollege of Chemistry and Chemical Engineering, Inner Mongolia University, Hohhot 010021, ChinaOwing to a lack of methodology for rationally and selectively synthesizing twisted nanographenes, it is usually inevitable that we obtain nanographenes as a mixture with various geometries, such as unidirectionally twisted, alternatively twisted, randomly twisted, and even wavy structures, reflecting the high activation barriers among them. Otherwise, they are interconvertible if the barriers are low enough such that only averaged properties can be observed under a thermal equilibrium. Recently, we reported on a double-twisted nanographene containing four [6]helicene units within the skeleton. In this paper, we discuss the robust conformational stability of the nanographene, both experimentally and computationally. The results indicate that the nanographene could only be racemized at temperatures exceeding 200 °C, and the first flip of one of the four [6]helicene units is the rate-degerming step.https://www.mdpi.com/2079-4991/14/21/1737nanographenetwisthelicene
spellingShingle Penghui Song
Yoshifumi Hashikawa
Chaolumen
Twisted Nanographenes with Robust Conformational Stability
Nanomaterials
nanographene
twist
helicene
title Twisted Nanographenes with Robust Conformational Stability
title_full Twisted Nanographenes with Robust Conformational Stability
title_fullStr Twisted Nanographenes with Robust Conformational Stability
title_full_unstemmed Twisted Nanographenes with Robust Conformational Stability
title_short Twisted Nanographenes with Robust Conformational Stability
title_sort twisted nanographenes with robust conformational stability
topic nanographene
twist
helicene
url https://www.mdpi.com/2079-4991/14/21/1737
work_keys_str_mv AT penghuisong twistednanographeneswithrobustconformationalstability
AT yoshifumihashikawa twistednanographeneswithrobustconformationalstability
AT chaolumen twistednanographeneswithrobustconformationalstability