| Yazarlar |
Doç. Dr. Emine BABUR ŞAŞ
Kırşehir Ahi Evran Üniversitesi, Türkiye |
Nevin Çankaya
Uşak Üniversitesi, Türkiye |
Prof. Dr. Mustafa KURT
Kırşehir Ahi Evran Üniversitesi, Türkiye |
| Özet |
| In this work 2-(bis(cyanomethyl)amino)-2-oxoethyl methacrylate monomer has been synthesized as newly, characterized both experimentally and theoretically. Experimentally, it has been characterized by FT-IR, FT-Raman, H-1 and C-13 NMR spectroscopy techniques. The theoretical calculations have been performed with Density Functional Theory (DFT) including B3LYP method. The scaled theoretical wave numbers have been assigned based on total energy distribution (TED). Electronic properties of monomer have been performed using time-dependent TD-DFT/B3LYP/B3LYP/6-311G++(d,p) method. The results of experimental have been compared with theoretical values. Both experimental and theoretical methods have shown that the monomer was suitable for the literature. (C) 2018 Elsevier B.V. All rights reserved. |
| Anahtar Kelimeler |
| DFT | FT-Raman | FT-IR | NMR |
| 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 | 06-2018 |
| Cilt No | 1161 |
| Sayfalar | 433 / 441 |
| Doi Numarası | 10.1016/j.molstruc.2018.01.088 |
| Makale Linki | https://linkinghub.elsevier.com/retrieve/pii/S0022286018301273 |
| Atıf Sayıları | |
| WoS | 6 |
| Google Scholar | 9 |
