Unveiling the potential of high-energy heat-resistant pyrazine, pyrimidine and pyridazine substituted tetranitrodibenzo-tetraazapentalene (TACOT) derivatives.

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Title: Unveiling the potential of high-energy heat-resistant pyrazine, pyrimidine and pyridazine substituted tetranitrodibenzo-tetraazapentalene (TACOT) derivatives.
Authors: Rani R; Department of Chemistry, National Institute of Technology Kurukshetra, Kurukshetra, 136119, Haryana, India., Gupta A; Department of Chemistry, National Institute of Technology Kurukshetra, Kurukshetra, 136119, Haryana, India., Ghule VD; Department of Chemistry, National Institute of Technology Kurukshetra, Kurukshetra, 136119, Haryana, India. gvd@nitkkr.ac.in., Dharavath S; Energetic Materials Laboratory, Department of Chemistry, Indian Institute of Technology Kanpur, Kanpur, 208016, Uttar Pradesh, India.
Source: Journal of molecular modeling [J Mol Model] 2026 Jun 03; Vol. 32 (7). Date of Electronic Publication: 2026 Jun 03.
Publication Type: Journal Article
Journal Info: Publisher: Springer Country of Publication: Germany NLM ID: 9806569 Publication Model: Electronic Cited Medium: Internet ISSN: 0948-5023 (Electronic) Linking ISSN: 09485023 NLM ISO Abbreviation: J Mol Model Subsets: MEDLINE; PubMed not MEDLINE
Database: MEDLINE Ultimate
Description
ISSN:0948-5023
DOI:10.1007/s00894-026-06793-6