A theoretical evaluation for new fused remote N-heterocyclic silylenes (RNHSis) using density functional theory

Ghaghaei, M; Babazadeh, M; Behmagham, F; Edjlali, L; Vessally, E

Babazadeh, M (通讯作者),Islamic Azad Univ, Dept Chem, Tabriz Branch, Tabriz, Iran.;Behmagham, F (通讯作者),Islamic Azad Univ, Dept Chem, Miyandoab Branch, Miyandoab, Iran.

JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 2023; 36 (4):

Abstract

In this research, we compare and contrast the stability, polarity, polarizability, band gap, and global reactivity of singlet (s) and triplet (t) fuse......

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