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Quantum chemical calculations based on 4,5-di(1,2,4-oxadiazol-3-yl)-2H-1,2,3-triazole and 3,3′ -(2H-1,2,3-triazole-4,5-diyl)-bis(1,2,4-oxadiazol-5(4H)-one) derivatives: a DFT study

Crossref DOI link: https://doi.org/10.1007/s00894-025-06473-x

Published Online: 2025-08-21

Published Print: 2025-09

Update policy: https://doi.org/10.1007/springer_crossmark_policy

Authors

Zhu, Yang

Zhang, Peng

Chu, YuQin

Jiang, Wen

Ma, Peng

Ma, CongMing
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Text and Data Mining valid from 2025-08-21

Version of Record valid from 2025-08-21
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Article History

Received: 9 June 2025

Accepted: 2 August 2025

First Online: 21 August 2025

Declarations

:

: We allow the journal to review all the data, and we confirm the validity of the results. There are no financial relationships.

: All the authors agree to participate in this investigation.

: All the authors agree to publish the manuscript.

: The authors declare no competing interests.

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