Experimental and Theoretical Vibrational Spectroscopic Investigations, DFT quantum chemical analysis, Biological activities and Molecular docking on 4,4′-Dimethoxy-2,2′-Bipyridine
  
Yazarlar (3)
Meryem Alp Gazi Üniversitesi, Türkiye
Senay Yurdakul Gazi Üniversitesi, Türkiye
Prof. Dr. Belgin ERDEM Kırşehir Ahi Evran Üniversitesi, Türkiye
Makale Türü Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale)
Dergi Adı Journal of Molecular Structure (Q3)
Dergi ISSN 0022-2860 Wos Dergi Scopus Dergi
Dergi Tarandığı Indeksler SCI
Makale Dili İngilizce Basım Tarihi 07-2022
Cilt / Sayı / Sayfa 1260 / 1 / 32846–0 DOI 10.1016/j.molstruc.2022.132846
Makale Linki http://dx.doi.org/10.1016/j.molstruc.2022.132846
Özet
The present study describes the torsional potentials, molecular geometry in monomer and dimer forms of purchased 4,4’-dimethoxy-2,2’-bipyridine (Dmobpy). The results of experimental Fourier Transform Infrared (FT-IR) and Raman (FT-RA) spectra were compared with theoretical data. Quantum chemical calculations on the optimized molecular geometries an...
Anahtar Kelimeler
4,4′-dimethoxy-2,2′-bipyridine | Antimicrobial activity and Molecular docking | DFT | Photoluminescence | Thermodynamic properties | Vibrational spectra