Experimental and theoretical analysis of 2-amino 1-methylbenzimidazole molecule based on DFT
Yazarlar (3)
Prof. Dr. Emine BABUR ŞAŞ Kırşehir Ahi Evran Üniversitesi, Türkiye
M. Cevik
Kırşehir Ahi Evran Üniversitesi, Türkiye
Kırşehir Ahi Evran Üniversitesi, Türkiye
M. Kurt
Kırşehir Ahi Evran Üniversitesi, Türkiye
Kırşehir Ahi Evran Üniversitesi, Türkiye
| Makale Türü | Özgün Makale (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 | ||
| Makale Dili | İngilizce | Basım Tarihi | 08-2017 |
| Cilt / Sayı / Sayfa | 1149 / 1 / 882–892 | DOI | 10.1016/j.molstruc.2017.07.055 |
| Özet |
| In this work were shown spectroscopic properties, molecular structure and electronic properties of 2-amino 1 methyl benzimidazole molecule. The theoretical calculations in the title molecule were performed with density functional theory method. Experimental wavenumber of 2-amino 1 methyl benzimidazole molecule were recorded with FT-Raman, dispersive Raman and FT-IR between 4000 and 0, 4000–400 and 4000-370 cm−1, respectively. The scaled theoretical wavenumber are assigned based on total energy distribution. Other experimental spectra were recorded in specific solvents. |
| Anahtar Kelimeler |
| 2-Amino 1-methyl benzimidazole | Density functional theory | Dispersive Raman | FT-Raman | FT–IR |
Science Direct
Experimental and theoretical analysis of 2-amino 1-methylbenzimidazole molecule based on DFT
BM Sürdürülebilir Kalkınma Amaçları
| Atıf Sayıları | |
| Scopus | 17 |
| Web of Science | 17 |