Sulfonamide-derived hydrazone compounds and their Pd (II) complexes: Synthesis, spectroscopic characterization, X-ray structure determination, in vitro antibacterial activity and computational studies
Yazarlar (4)
Prof. Dr. Neslihan ÖZBEK Kırşehir Ahi Evran Üniversitesi, Türkiye
Ümmühan Özmen Özdemir
Gazi Üniversitesi, Türkiye
Ahmet Fazıl Altun Gazi Üniversitesi, Türkiye
Ertan Şahin Atatürk Üniversitesi, Türkiye
Makale Türü Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale)
Dergi Adı Journal of Molecular Structure (Q3)
Dergi ISSN 0022-2860 Wos Dergi Scopus Dergi
Dergi Tarandığı Indeksler SCI
Makale Dili İngilizce Basım Tarihi 11-2019
Kabul Tarihi 12-04-2026 Yayınlanma Tarihi
Cilt / Sayı / Sayfa 1196 / 1 / 707–719 DOI 10.1016/j.molstruc.2019.07.016
Makale Linki https://linkinghub.elsevier.com/retrieve/pii/S0022286019308506
Özet
A new sulfonamide-derived prophane sulfonyl hydrazone compounds: 2-hydroxy- acetophenoneprophanesulfonylhydrazone (afpsh), 5-Cl-2-hydroxyacetophenoneprophane sulfonylhydrazone (5-Clafpsh), 3,5-di-tert-butyl-2-hydroxybenzaldehydeprophanesulfonyl hydrazone (3,5tbsalpsh) and their Pd(II) complexes were synthesized. The characterization of all compounds was characterized by 1H NMR, 13C NMR, FT-IR, Mass spectral data, elemental analysis and magnetic susceptibility measurements. The crystal structure of afpsh was determined by single crystal X-ray diffraction methods. 1H and 13C shielding tensors of afpsh were calculated with GIAO/DFT/B3LYP/6–311++G(d,p) methods in DMSO. Molecular electrostatic potential surface and frontier orbital analysis were also carried out. HOMO-LUMO energy gap was calculated which allowed the calculation of relative reactivity descriptors like chemical …
Anahtar Kelimeler
Antimicrobial activity | Computational studies | Pd(II) complexes | Sulfonamide-derived sulfonyl hydrazones