| Yazarlar |
Prof. Dr. Fatma KANDEMİRLİ
Kastamonu Üniversitesi, Türkiye |
Murat Saracoǧlu
Erciyes Üniversitesi, Turkey |
|
Gamze Bulut
Kocaeli Üniversitesi, Turkey |
|
Eno Ebenso
North-West University, South Africa |
|
Taner Arslan
Eskişehir Osmangazi Üniversitesi, Turkey |
|
Asgar Kayan
Kocaeli Üniversitesi, Turkey |
| Özet |
| Zinc(II) and nickel(II)-complexes of 5-methoxyisatin 3-[N-(4- chlorophenyl) thiosemicarbazone] (H 2MICP) were synthesized and characterized by infrared, ultraviolet and 1H-NMR spectroscopies as well as elemental analysis. Model of H 2MICP and its zinc(II) and nickel(II)-complexes were optimized with B3LYP method using 6-31G(d,p), 6-311G(d,p), 6-311++G(d,p), 6-311++G(2d,2p) basis sets. The calculated 1H-NMR, UV and IR spectra data were compared with experimental results. In addition to the Natural Bond Orbital (NBO) analysis of H 2MICP and its Zinc(II) and Nickel(II) complexes, Fukui functions of H 2MICP were also reported. © 2012 Published by LPPM ITB. |
| Anahtar Kelimeler |
| DFT | Isatin thiosemicarbazones | Zn (II) and Ni (II)-complexes |
| Makale Türü | Özgün Makale |
| Makale Alt Türü | Uluslararası alan indekslerindeki dergilerde yayımlanan tam makale |
| Dergi Adı | ITB Journal of Sciences |
| Dergi ISSN | 1978-3043 |
| Dergi Tarandığı Indeksler | Chemical Abstract |
| Makale Dili | İngilizce |
| Basım Tarihi | 01-2012 |
| Cilt No | 44 |
| Sayı | 1 |
| Sayfalar | 35 / 50 |
| Doi Numarası | 10.5614/itbj.sci.2012.44.1.4 |
| Makale Linki | http://journal.itb.ac.id/index.php?li=article_detail&id=707 |
| Atıf Sayıları | |
| SCOPUS | 5 |
| Google Scholar | 10 |
