Synthesis, optical, electrochemical, and computational study of benzene/thiophene based D-π-A chromophores
The result's identifiers
Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F61388963%3A_____%2F24%3A00601034" target="_blank" >RIV/61388963:_____/24:00601034 - isvavai.cz</a>
Alternative codes found
RIV/00216224:14310/24:00137656 RIV/61989100:27740/24:10256724
Result on the web
<a href="https://doi.org/10.1039/D4RA02668C" target="_blank" >https://doi.org/10.1039/D4RA02668C</a>
DOI - Digital Object Identifier
<a href="http://dx.doi.org/10.1039/d4ra02668c" target="_blank" >10.1039/d4ra02668c</a>
Alternative languages
Result language
angličtina
Original language name
Synthesis, optical, electrochemical, and computational study of benzene/thiophene based D-π-A chromophores
Original language description
We report the design, synthesis, electrochemical, UV-vis, fluorescence, and computational study of nine π-linked donor–acceptor (D–π–A) chromophores. The series of novel compounds comprises a terphenyl, terthiophene, or 2,5-diphenyl thiophene linker, with one electron-donating group (methyl or p-N,N-diethyl) and one electron-withdrawing group (nitrone, formyl, or dicyanovinyl) at opposite ends of the molecule. The HOMO–LUMO gaps were determined via cyclic voltammetry and found to correspond well to DFT-calculated values. Furthermore, the influence of the π-linker character and substituent on the HOMO–LUMO gap was analysed and interpreted in terms of MO composition via DFT.
Czech name
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Czech description
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Classification
Type
J<sub>imp</sub> - Article in a specialist periodical, which is included in the Web of Science database
CEP classification
—
OECD FORD branch
10403 - Physical chemistry
Result continuities
Project
<a href="/en/project/LM2023055" target="_blank" >LM2023055: Czech National Infrastructure for Biological Data</a><br>
Continuities
I - Institucionalni podpora na dlouhodoby koncepcni rozvoj vyzkumne organizace
Others
Publication year
2024
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů
Data specific for result type
Name of the periodical
RSC Advances
ISSN
2046-2069
e-ISSN
2046-2069
Volume of the periodical
14
Issue of the periodical within the volume
48
Country of publishing house
GB - UNITED KINGDOM
Number of pages
14
Pages from-to
35424-35437
UT code for WoS article
001347611800001
EID of the result in the Scopus database
2-s2.0-85208284557