Syntheses, crystal structures, theoretical insights and DNA (1BNA) docking studies of 3-(3-oxo-1, 3-dihydroisobenzofuran-1-yl) aminobenzoic acid and its metal complexes
Yazarlar (5)
Dr. Öğr. Üyesi Azer ÖZEN Kafkas Üniversitesi, Türkiye
Füreya Elif Öztürkkan
Güventürk Uğurlu
Tuncer Hökelek
Hacali Necefoğlu Kafkas Üniversitesi
| Makale Türü | Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale) | ||
| Dergi Adı | Inorganica Chimica Acta (Q1) | ||
| Makale Dili | – | Basım Tarihi | 02-2026 |
| Cilt / Sayı / Sayfa | 0 / 0 / 123137–0 | DOI | – |
| Makale Linki | https://www.sciencedirect.com/science/article/pii/S0020169326000770 | ||
| UAK Araştırma Alanları |
Anorganik Kimya
|
||
| Özet |
| In this study, a new organic ligand derived from 3-(3-oxo-1,3-dihydroisobenzofuran-1-yl)aminobenzoic acid (1) and its Zn(II) (2) and Co(II) (3) complexes were synthesized. The structures of the synthesized compounds were comprehensively characterized by elemental analysis, NMR, FT-IR and UV–Vis spectroscopies and single crystal X-ray diffraction. The electronic properties, frontier orbital distributions, enhanced stabilities and charge transfer tendencies of the synthesized ligand and compounds were clarified by the DFT studies. Single crystal X-ray diffraction analyses showed that the asymmetric units of the complexes were containing only one molecule with the different coordination environments shaped by the steric and electronic contributions of the auxiliary ligands. FT-IR data indicated that both the carbonyl and amino groups play active roles in the coordination of the ligand, as confirmed by the … |
| Anahtar Kelimeler |
