Experimental study, theoretical calculations, investigation on the molecular docking, spectroscopic insights and antimicrobial appraisal of a new Co(II) complex DOI

Chaima Gharbi,

Ömer Tamer, Badiâa Essghaier

et al.

Polyhedron, Journal Year: 2024, Volume and Issue: 257, P. 117025 - 117025

Published: May 7, 2024

Language: Английский

Quantum computational investigation into the optoelectronic and NLO properties of C8H8O3.C3H7NO2 single crystal DOI
P. Jayaprakash, R. Ramachandran, S. Selvaraj

et al.

Journal of Molecular Structure, Journal Year: 2025, Volume and Issue: 1319, P. 139488 - 139488

Published: Jan. 1, 2025

Language: Английский

Citations

2
Exploring the structure and dynamics of a fluorescent schiff base (1E,1′E)-1,1′-(1,4-phenylene) bis(N-(4-chlorophenyl) methamine: Synthesis, spectroscopic analysis, thermal, electronic and crystallographic study with biological applications DOI

K.J. Rajimon,

Abdullah Yahya Abdullah Alzahrani, Deepthi S. Rajendran Nair

et al.

Journal of Molecular Structure, Journal Year: 2024, Volume and Issue: 1312, P. 138546 - 138546

Published: May 4, 2024

Language: Английский

Citations

11
X-ray diffraction, structural analysis, quantum reactivity studies, molecular interactions, spectroscopic insights and antiepileptic activities of [Cu(C7N4H8O2)2(NO3)(H2O)2]NO3 hybrid material by molecular docking DOI

Wijdène Nbili,

Rawlings A. Timothy,

Gaddafi I. Abubakar

et al.

Journal of Molecular Structure, Journal Year: 2024, Volume and Issue: 1307, P. 137933 - 137933

Published: March 2, 2024

Language: Английский

Citations

5
Heteroatoms chemical tailoring of aluminum nitrite nanotubes as biosensors for 5-hydroxyindole acetic acid (a biomarker for carcinoid tumors): insights from a computational study DOI
Chioma B. Ubah,

Martilda U. Akem,

Innocent Benjamin

et al.

Molecular Systems Design & Engineering, Journal Year: 2024, Volume and Issue: 9(8), P. 832 - 846

Published: Jan. 1, 2024

This study aims to elucidate the properties of aluminum nitrite nanotubes (AlNNT) encapsulated with phosphorus (P@AlNNT), sulphur (S@AlNNT), and silicon (Si@AlNNT) heteroatoms for use as biosensors 5-hydroxyindoleacetic acid (5HIAA).

Language: Английский

Citations

4
Syntheses, Crystal Structures and Antimicrobial Activity of Zinc(II) Complexes Derived from 5-Bromo-2- (((2-piperazin-1-yl)ethyl)imino)methyl)phenol DOI Creative Commons

Yin-Bing Chen,

Xiao‐Yang Qiu,

Meng-Yuan Xu

et al.

Acta chimica slovenica, Journal Year: 2024, Volume and Issue: 71(1), P. 135 - 142

Published: March 11, 2024

Three new zinc(II) complexes, [ZnCl2L]·CH3OH (1), [ZnClL(NCS)]·2CH3OH·0.5H2O (2), and [ZnL(NCS)2]·CH3OH·H2O (3), where L is the zwitterionic form of 5-bromo-2-(((2-piperazin-1-yl)ethyl)imino)methyl)phenol, NCS thiocyanate anion, were facile prepared by reaction different molar ratio L, zinc chloride ammonium in methanol. The complexes characterized IR UV-Vis spectroscopy. Detailed structures three confirmed single crystal X-ray determination. Zn atoms are tetrahedral coordination. Schiff base ligand coordinates to atom through phenolate oxygen amino imino nitrogen atoms. remaining two sites occupied Cl for 1, one 2, 3. compounds show significant antimicrobial activities.

Language: Английский

Citations

0
Experimental study, theoretical calculations, investigation on the molecular docking, spectroscopic insights and antimicrobial appraisal of a new Co(II) complex DOI

Chaima Gharbi,

Ömer Tamer, Badiâa Essghaier

et al.

Polyhedron, Journal Year: 2024, Volume and Issue: 257, P. 117025 - 117025

Published: May 7, 2024

Language: Английский

Citations

0