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

и другие.

Polyhedron, Год журнала: 2024, Номер 257, С. 117025 - 117025

Опубликована: Май 7, 2024

Язык: Английский

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

и другие.

Journal of Molecular Structure, Год журнала: 2025, Номер 1319, С. 139488 - 139488

Опубликована: Янв. 1, 2025

Язык: Английский

Процитировано

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

и другие.

Journal of Molecular Structure, Год журнала: 2024, Номер 1312, С. 138546 - 138546

Опубликована: Май 4, 2024

Язык: Английский

Процитировано

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

и другие.

Journal of Molecular Structure, Год журнала: 2024, Номер 1307, С. 137933 - 137933

Опубликована: Март 2, 2024

Язык: Английский

Процитировано

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

и другие.

Molecular Systems Design & Engineering, Год журнала: 2024, Номер 9(8), С. 832 - 846

Опубликована: Янв. 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).

Язык: Английский

Процитировано

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

и другие.

Acta chimica slovenica, Год журнала: 2024, Номер 71(1), С. 135 - 142

Опубликована: Март 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.

Язык: Английский

Процитировано

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

и другие.

Polyhedron, Год журнала: 2024, Номер 257, С. 117025 - 117025

Опубликована: Май 7, 2024

Язык: Английский

Процитировано

0