| Yazarlar (3) |
Doç. Dr. Sibel ÇELİK
Kırşehir Ahi Evran Üniversitesi, Türkiye |
Şenay Yurdakul
Gazi Üniversitesi, Türkiye |
Prof. Dr. Belgin ERDEM
Kırşehir Ahi Evran Üniversitesi, Türkiye |
| 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 inter-actions in the structure were analyzed by topological AIM, RDG, and NBO approaches. Compound [Ag(4-pyridinecarboxaldehyde)(4)]NO3 proved to be the most active compound in this study and showed the highest antibacterial activity against S. aureus ATCC 29,213 , S. epidermidis ATCC 35,984 and P. aeruginosa ATCC 27,853 . Test compound was examined for antiquorum-sensing activity against C. violaceum ATCC 12,472 and title compound exhibited good antiquorum-sensing activity. In addition, these compound activity relationships were further supported by in-silico molecular docking studies where some of the active title compound showed maximum dock score. (c) 2022 Elsevier B.V. All rights reserved. |
| Anahtar Kelimeler |
| 4-pyridinecarboxaldehyde | Antibacterial | Antiquorum-sensing | Molecular docking | AIM | DFT |
| Makale Türü | Özgün Makale |
| Makale Alt Türü | SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale |
| Dergi Adı | Journal of Molecular Structure |
| Dergi ISSN | 0022-2860 Wos Dergi Scopus Dergi |
| Dergi Tarandığı Indeksler | SCI-Expanded |
| Dergi Grubu | Q3 |
| Makale Dili | İngilizce |
| Basım Tarihi | 03-2022 |
| Cilt No | 1261 |
| Sayfalar | 132902 / 0 |
| Doi Numarası | 10.1016/j.molstruc.2022.132902 |
| Makale Linki | http://dx.doi.org/10.1016/j.molstruc.2022.132902 |
| Atıf Sayıları | |
| WoS | 19 |
