| Yazarlar |
Yusuf Erdoğdu
Gazi Üniversitesi, Türkiye |
|
Ümran Ceren Baskose
|
|
Semran Sağlam
Gazi Üniversitesi, Türkiye |
Prof. Dr. Makbule ERDOĞDU
Kırşehir Ahi Evran Üniversitesi, Türkiye |
Prof. Dr. Hatice ÖĞÜTCÜ
Kırşehir Ahi Evran Üniversitesi, Türkiye |
|
Süleyman Özçelik
Gazi Üniversitesi, Türkiye |
| Özet |
| The structural, thermal, spectroscopic, electronic and biological activity properties of the Coumarin-153 molecule report herein a joint experimental and theoretical investigation. Fourier Transform Infrared (FT-IR), Nuclear Magnetic Resonance (NMR) and Ultra Violet (UV) spectroscopy are used to probe the spectroscopic properties of the Coumarin-153 molecule. Theoretical vibrational, NMR and UV-Vis spectroscopic, structural and some electronic properties of Coumarin-153 molecule were estimated by Density Functional Theory (DFT). In the DFT calculations, the B3LYP functional with 6-311G(d,p) basis sets were applied to carry out the quantum mechanical calculations. Some features just mentioned were visualized. In addition, Coumarin-153 molecule was also evaluated for antibacterial and antifungal activities against pathogenic bacteria (Gram negative and Gram positive) and yeast. (C) 2020 Elsevier B.V. All rights reserved. |
| Anahtar Kelimeler |
| Coumarin-153, Density functional theory (DFT), Vibrational spectroscopy, Anti-microbial activity |
| Makale Türü | Özgün Makale |
| Makale Alt Türü | SSCI, AHCI, SCI, SCI-Exp dergilerinde yayımlanan tam makale |
| Dergi Adı | JOURNAL OF MOLECULAR STRUCTURE |
| Dergi ISSN | 0022-2860 |
| Dergi Tarandığı Indeksler | SCI-Expanded |
| Makale Dili | İngilizce |
| Basım Tarihi | 12-2020 |
| Cilt No | 1221 |
| Sayfalar | 128873 / |
| Doi Numarası | 10.1016/j.molstruc.2020.128873 |
| Atıf Sayıları | |
| SCOPUS | 11 |
| Google Scholar | 11 |
