New silver(I) complex as antibiotic candidate: Synthesis, spectral characterization, DFT, QTAIM and antibacterial investigations and docking properties
Yazarlar (3)
Doç. Dr. Sibel ÇELİK Kırşehir Ahi Evran Üniversitesi, Türkiye
Senay Yurdakul Gazi Üniversitesi
Prof. Dr. Belgin ERDEM Kırşehir Ahi Evran Üniversitesi, Türkiye
Makale Türü Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale)
Dergi Adı Elsevier BV (Q3)
Dergi ISSN 0022-2860 Wos Dergi Scopus Dergi
Dergi Tarandığı Indeksler SCI-Expanded
Makale Dili İngilizce Basım Tarihi 08-2022
Kabul Tarihi 12-04-2026 Yayınlanma Tarihi
Cilt / Sayı / Sayfa 1261 / 1 / 132902–0 DOI 10.1016/j.molstruc.2022.132902
Makale Linki http://dx.doi.org/10.1016/j.molstruc.2022.132902
Özet
In the present work, a newly synthesized silver(I) complex was characterized using elemental analysis, UV–Vis spectroscopy, and infrared spectroscopy. DFT calculations at the B3LYP/LANL2DZ level were used to investigate structural, electronic, and spectroscopic properties. The intermolecular interactions in the structure were analyzed by topologica...
Anahtar Kelimeler
4-pyridinecarboxaldehyde | AIM | Antibacterial | Antiquorum-sensing | DFT | Molecular docking