Synthesis and characterization of coumarin based 1, 3, 4-oxadiazole: Exploring optoelectronic applications, thermal properties and theoretical study

•Synthesized a novel coumarin based 1,3,4-oxadiazole derivatives.•Photophysical properties of synthesized derivatives were studied in detail.•The synthesized compounds are thermally stable.•Optical band gap values are range from 3.04 eV to 3.47 eV. A novel 1,3,4-oxadiazole linked coumarin dyes have...

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Published in:Journal of molecular structure Vol. 1290; p. 135887
Main Authors: Patil, Anilkumar R., Tilakraj, T.S., Shastri, Samundeeswari L., Shanbhag, Arpita A., Shastri, Lokesh A., Bhat, Vighneshwar S., Inamdar, Sanjeev R.
Format: Journal Article
Language:English
Published: Elsevier B.V 15-10-2023
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Abstract •Synthesized a novel coumarin based 1,3,4-oxadiazole derivatives.•Photophysical properties of synthesized derivatives were studied in detail.•The synthesized compounds are thermally stable.•Optical band gap values are range from 3.04 eV to 3.47 eV. A novel 1,3,4-oxadiazole linked coumarin dyes have been synthesised and are characterised by IR, NMR and Mass analysis. Several coumarin and oxadiazole derivatives have been patented for a variety of optoelectronic applications such as; fluorescent materials, photographic sensitizers, optical brighteners and organic light emitting diodes etc. Hence these new class of organic compounds were examined for their fluorescent properties and found to emit green light in the visible region of the spectrum with very high stokes shift values. The electronic structure of synthesized coumarin-based donor-π-acceptor (D-π-A)-type organic dyes has been examined by using Density Functional theory (DFT). TGA and DSC analysis of the compounds shows that, they are highly stable (>250 °C). [Display omitted]
AbstractList •Synthesized a novel coumarin based 1,3,4-oxadiazole derivatives.•Photophysical properties of synthesized derivatives were studied in detail.•The synthesized compounds are thermally stable.•Optical band gap values are range from 3.04 eV to 3.47 eV. A novel 1,3,4-oxadiazole linked coumarin dyes have been synthesised and are characterised by IR, NMR and Mass analysis. Several coumarin and oxadiazole derivatives have been patented for a variety of optoelectronic applications such as; fluorescent materials, photographic sensitizers, optical brighteners and organic light emitting diodes etc. Hence these new class of organic compounds were examined for their fluorescent properties and found to emit green light in the visible region of the spectrum with very high stokes shift values. The electronic structure of synthesized coumarin-based donor-π-acceptor (D-π-A)-type organic dyes has been examined by using Density Functional theory (DFT). TGA and DSC analysis of the compounds shows that, they are highly stable (>250 °C). [Display omitted]
ArticleNumber 135887
Author Patil, Anilkumar R.
Shastri, Lokesh A.
Shastri, Samundeeswari L.
Shanbhag, Arpita A.
Bhat, Vighneshwar S.
Tilakraj, T.S.
Inamdar, Sanjeev R.
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  surname: Tilakraj
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  organization: Department of Physics, Karnatak University, Dharwad, 580 003, Karnataka, India
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  givenname: Samundeeswari L.
  surname: Shastri
  fullname: Shastri, Samundeeswari L.
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  givenname: Arpita A.
  surname: Shanbhag
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  givenname: Lokesh A.
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  givenname: Vighneshwar S.
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  surname: Bhat
  fullname: Bhat, Vighneshwar S.
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  givenname: Sanjeev R.
  surname: Inamdar
  fullname: Inamdar, Sanjeev R.
  organization: Department of Physics, Karnatak University, Dharwad, 580 003, Karnataka, India
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Keywords Photophysical properties
1,3,4-oxadiazole
Thermal stability
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Snippet •Synthesized a novel coumarin based 1,3,4-oxadiazole derivatives.•Photophysical properties of synthesized derivatives were studied in detail.•The synthesized...
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SubjectTerms 1,3,4-oxadiazole
HOMO-LUMO
Photophysical properties
Thermal stability
Title Synthesis and characterization of coumarin based 1, 3, 4-oxadiazole: Exploring optoelectronic applications, thermal properties and theoretical study
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