B. Naderizadeh, M. Bayat, “Nature of metal–NHC bonds in some potential anticancer [(NHC(R))2→M]+ (M=CuI, AgI, AuI, R=n-propyl, n-butyl, n-pentyl, n-hexyl, n-heptyl, n-octyl, n-nonyl, n-decyl) complexes”, Mendeleev Commun., 31:2 (2021), 179

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Mendeleev Communications, 2021, Volume 31, Issue 2, Pages 179–181
DOI: https://doi.org/10.1016/j.mencom.2021.03.011 (Mi mendc871)

This article is cited in 6 scientific papers (total in 6 papers)

Communications

Nature of metal–NHC bonds in some potential anticancer [(NHC(R))₂→M]⁺ (M=Cu^I, Ag^I, Au^I, R=n-propyl, n-butyl, n-pentyl, n-hexyl, n-heptyl, n-octyl, n-nonyl, n-decyl) complexes

B. Naderizadeh, M. Bayat

Faculty of Chemistry, Bu-Ali Sina University, Hamadan, Iran

Full-text PDF (543 kB) Citations (6)

DOI: https://doi.org/10.1016/j.mencom.2021.03.011

Graphic abstract: Nature of metal–NHC bonds in some potential anticancer [(NHC(R))<sub>2</sub>→M]<sup>+</sup> (M=Cu<sup>I</sup>, Ag<sup>I</sup>, Au<sup>I</sup>, R=<i>n</i>-propyl, <i>n</i>-butyl, <i>n</i>-pentyl, <i>n</i>-hexyl, <i>n</i>-heptyl, <i>n</i>-octyl, <i>n</i>-nonyl, <i>n</i>-decyl) complexes

Abstract: A theoretical study of the structures and nature of the M←C bonds in NHC Cu^I, Ag^I and Au^I cation complexes with two N,N′-dialkylbenzimidazolin-2-ylidene ligands was performed using natural bond orbital (NBO), atoms in molecules (AIM), energy decomposition analysis (EDA), and extended transitionstate natural orbital for chemical valence (ETS-NOCV) analysis. Results demonstrated that the nature of M←C bonds in the complexes is more electrostatic. The complexes studied may be regarded as potentially anticancer agents.

Keywords: N-heterocyclic carbenes, copper complexes, silver complexes, gold complexes, anticancer agents, theoretical studies.

Document Type: Article

Language: English

Citation: B. Naderizadeh, M. Bayat, “Nature of metal–NHC bonds in some potential anticancer [(NHC(R))₂→M]⁺ (M=Cu^I, Ag^I, Au^I, R=n-propyl, n-butyl, n-pentyl, n-hexyl, n-heptyl, n-octyl, n-nonyl, n-decyl) complexes”, Mendeleev Commun., 31:2 (2021), 179–181

Linking options:

https://www.mathnet.ru/eng/mendc871

https://www.mathnet.ru/eng/mendc/v31/i2/p179

This publication is cited in the following 6 articles:

Khadijeh Naeimi, Mehdi Bayat, Ehsan Alavi Pour, “Trinuclear cylinder-like potential anticancer and antibacterial Cu(i), Ag(i) and Au(i) nano-sized cationic complexes with tris-NHC ligands: cationic M3 metal cluster displaying positive or negative cooperativity in triad [L2(R)6→M3]3+ complexes?”, RSC Adv., 15:9 (2025), 6742
Ayten Behçet, Parham Taslimi, Betül Şen, Tuğba Task{\i}n‐Tok, Ayd{\i}n Aktaş, Yetkin Gök, Muhittin Aygün, İlhami Gülçin, “New palladium complexes with N‐heterocyclic carbene and morpholine ligands: Synthesis, characterization, crystal structure, molecular docking, and biological activities”, J Biochem & Molecular Tox, 38:1 (2024)
Babak Golzadeh, Bahram Taghizadeh Darban, Alireza Akbari, “Introduction of 5-membered boron-oxygen-heterocyclic carbene and its Si and Ge homologs and the M–L bonding analysis in their complexes with coinage metals: A theoretical study”, Computational and Theoretical Chemistry, 1235 (2024), 114498
Bahareh Naderizadeh, Mehdi Bayat, “Chemical bonding in some anticancer NHC complexes [RʹC≡C → ML] (M=Cu (I), Ag (I), Au (I); Rʹ=C10H7 and C9NH12SO2; L=NHC (R) and P (R)3; and R=F, Cl, Br, H, CH3, SiH3, Ph)”, J IRAN CHEM SOC, 21:11 (2024), 2775
V. N. Mikhaylov, I. A. Balova, “Alternative Transformations of N-Heterocyclic Carbene Complexes of the Group 11 Metals in Transmetalation Reactions (A Review)”, Russ J Gen Chem, 91:11 (2021), 2194
Bahareh Naderizadeh, Mehdi Bayat, Mohammad Ranjbaran, Sadegh Salehzadeh, “Towards computational prediction of anti-cancer activity: Making connection between IC50 values and metal–ligand interaction energies in some NHC complexes of groups 10 and 11”, Journal of Molecular Liquids, 341 (2021), 117310

Citing articles in Google Scholar: Russian citations, English citations
Related articles in Google Scholar: Russian articles, English articles

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