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Substituent influence of heteroatom on the novel remote N-heterocyclic silylenes (RNHSis) using density functional theory
Phosphorus, Sulfur, and Silicon and the Related Elements ( IF 1.3 ) Pub Date : 2023-07-06 , DOI: 10.1080/10426507.2023.2223746 Masoud Ghaghaei 1 , Mirzaagha Babazadeh 1 , Farnaz Behmagham 2 , Ladan Edjlali 1 , Esmail Vessally 3
Phosphorus, Sulfur, and Silicon and the Related Elements ( IF 1.3 ) Pub Date : 2023-07-06 , DOI: 10.1080/10426507.2023.2223746 Masoud Ghaghaei 1 , Mirzaagha Babazadeh 1 , Farnaz Behmagham 2 , Ladan Edjlali 1 , Esmail Vessally 3
Affiliation
In this work, we have compared and contrasted the stability, polarity, polarizability, frequency, band gap, charge distribution, and global reactivity of singlet (s) and triplet (t) states of the f...
中文翻译：
利用密度泛函理论研究杂原子取代对新型远程N-杂环硅烯（RNHSis）的影响
在这项工作中，我们比较和对比了 f 的单重态 (s) 和三重态 (t) 态的稳定性、极性、极化率、频率、带隙、电荷分布和全局反应性。
更新日期：2023-07-06
中文翻译：
利用密度泛函理论研究杂原子取代对新型远程N-杂环硅烯（RNHSis）的影响
在这项工作中，我们比较和对比了 f 的单重态 (s) 和三重态 (t) 态的稳定性、极性、极化率、频率、带隙、电荷分布和全局反应性。
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