Six-coordinated complexes of Co(II), Ni(II) and Cu(II) chlorides with N-propargylimidazoles: Synthesis, structure, antimicrobial activity, AIM analysis and molecular docking

被引：1

作者：

V. Sterkhova, Irina ^{[1
]}

Parshina, Lidya N. ^{[1
]}

Grishchenko, Lyudmila A. ^{[1
]}

Borodina, Tat'yana N. ^{[1
]}

Belovezhets, Lyudmila A. ^{[1
]}

Semenov, Valentin A. ^{[1
]}

机构：

[1] Russian Acad Sci, A E Favorsky Irkutsk Inst Chem, Siberian Branch, 1 Favorsky St, Irkutsk 664033, Russia

来源：

POLYHEDRON | 2024年 / 260卷

基金：

俄罗斯科学基金会;

关键词：

N-Propargylimidazole; Cobalt(II); Nickel(II); Copper(II); X-ray analysis; AIM analysis; Antimicrobial activity; Molecular docking; CRYSTAL-STRUCTURE; METAL-COMPLEX; COPPER(II); NICKEL(II); INHIBITORS; IRON(III); BONDS;

D O I：

10.1016/j.poly.2024.117093

中图分类号：

O61 [无机化学];

学科分类号：

070301 ; 081704 ;

摘要：

New six-coordinated N-propargylimidazole complexes with cobalt(II), nickel(II) and copper(II) chlorides, [M(Npropargylimidazole)4Cl2], were obtained in good yields by the reaction of N-propargylimidazole with corresponding metal chlorides. Molecular and crystal structures of compounds 1-3 were studied by X-ray analysis. Numerous non-covalent interactions including halogen bonds and pi-stacking forms in the crystal were analyzed in the framework of quantum theory Atom in molecules. An evaluation of the antimicrobial activity of Npropargylimidazole complexes with Co(II), Ni(II) and Cu(II) chlorides in relation to E. durans, B. subtilis and E. coli showed that the complexes of nickel exhibit antimicrobial activity comparable to gentamicin in relation to E. coli. To explore the inhibitory activity mechanism the molecular docking was carry out.

引用

页数：11

共 80 条

[1] NEW IRON(III), COBALT(II), NICKEL(II), COPPER(II), ZINC(II) MIXED-LIGAND COMPLEXES: SYNTHESIS, STRUCTURAL, DFT, MOLECULAR DOCKING AND ANTIMICROBIAL ANALYSIS
Abd El-Lateef, Hany M.
Ali, Ali M.
Khalaf, Mai M.
Abdou, Aly
[J]. BULLETIN OF THE CHEMICAL SOCIETY OF ETHIOPIA, 2024, 38 (01) : 147 - 166
[2] Agbaje A.G.B., FUDMA J. Sci., V7
[3] Structural and kinetic analyses of penicillin-binding protein 4 (PBP4)-mediated antibiotic resistance in Staphylococcus aureus
Alexander, J. Andrew N.
Chatterjee, Som S.
Hamilton, Stephanie M.
Eltis, Lindsay D.
Chambers, Henry F.
Strynadka, Natalie C. J.
[J]. JOURNAL OF BIOLOGICAL CHEMISTRY, 2018, 293 (51) : 19854 - 19865
[4] Synthesis, DFT, Biological and Molecular Docking Analysis of Novel Manganese(II), Iron(III), Cobalt(II), Nickel(II), and Copper(II) Chelate Complexes Ligated by 1-(4-Nitrophenylazo)-2-naphthol
Alghuwainem, Yousef A. A.
Abd El-Lateef, Hany M.
Khalaf, Mai M.
Amer, Amer A.
Abdelhamid, Antar A.
Alzharani, Ahmed A.
Alfarsi, Anas
Shaaban, Saad
Gouda, Mohamed
Abdou, Aly
[J]. INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, 2022, 23 (24)
[5] [Anonymous], 2018, Schrodinger Release 2018-3
[6] [Anonymous], 2001, Bruker
[7] Synthesis and characterization of transition metal fluoride complexes with imidazole: X-ray crystal structure reveals short hydrogen bonds between lattice water and lattice fluoride
Arif, M.
Nazir, S.
Iqbal, M. S.
Anjum, S.
[J]. INORGANICA CHIMICA ACTA, 2009, 362 (05) : 1624 - 1628
[8] ATOMS IN MOLECULES
BADER, RFW
[J]. ACCOUNTS OF CHEMICAL RESEARCH, 1985, 18 (01) : 9 - 15
[9] A bond path: A universal indicator of bonded interactions
Bader, RFW
[J]. JOURNAL OF PHYSICAL CHEMISTRY A, 1998, 102 (37) : 7314 - 7323
[10] Atoms in molecules as non-overlapping, bounded, space-filling open quantum systems
Bader, Richard F. W.
Matta, Cherif F.
[J]. FOUNDATIONS OF CHEMISTRY, 2013, 15 (03) : 253 - 276

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