Development of tripodal imine metal chelates: Synthesis, physicochemical inspection, theoretical studies and biomedical evaluation

HA Qasem, FN Sayed, M Feizi-Dehnayebi… - Inorganic Chemistry …, 2024 - Elsevier
Direct condensation of 2-acetylferrocene with tris (2-aminoethyl) amine resulted in a novel
tripodal imine ligand (L). Treatment of the metals' chlorides (Fe 3+, Cr 3+, Co 2+, Ni 2+, Cu …

Tuning the push–pull configuration for efficient second-order nonlinear optical properties in some chalcone derivatives

S Muhammad, AG Al-Sehemi, A Irfan… - Journal of Molecular …, 2016 - Elsevier
Using the density functional theory methods, we effectively tune the second-order nonlinear
optical (NLO) properties in some chalcone derivatives. Various unique push–pull …

[HTML][HTML] Non-symmetrical 1, 3, 4-oxadiazole derivatives: synthesis, characterization, and computational study of their optical properties

MSS Oliveira, ABS Santos, TVB Ferraz… - Chemical Physics …, 2023 - Elsevier
Applications in electronics and photonics have spurred research on new electronic and
optical materials, including organic chromophores. In this work, we synthesized and …

Synthesis, characterization and anti-cancer properties of water-soluble bis (PYE) pro-ligands and derived palladium (II) complexes

MN Zafar, S Masood, TST Muhammad… - Dalton …, 2019 - pubs.rsc.org
The two cationic palladium (II) complexes,[Pd (Len) 2][OTf] 2 (4) and [Pd (Lphen) 2][OTf] 2
(5), were synthesized by treatment of bis (benzonitrile) dichloropalladium (II) with …

Pd (II) complexes with chelating N-(1-alkylpyridin-4 (1H)-ylidene) amide (PYA) ligands: Synthesis, characterization and evaluation of anticancer activity

MN Zafar, AM Butt, F Perveen, MF Nazar… - Journal of Inorganic …, 2021 - Elsevier
Abstract The bidentate N-(1-Alkylpyridin-4 (1H)-ylidene) amide (PYA) pro-ligands [H 2 L
Bn][Cl] 2 (2), and [H 2 L Me][TfO] 2 (3) were prepared by simple alkylation reactions of the …

The effect of structural modification of novel D-π-A-π-D molecules on their performance as donors in bulk heterojunction solar cells: Theoretical investigation

Y Bouzineb, A Fitri, AT Benjelloun, M Benzakour… - Computational and …, 2024 - Elsevier
We have used density functional theory (DFT) and time-dependent density functional theory
(TD-DFT) to perform a theoretical study of seven novel small molecules SMi (i= 1–7) …

Synthesis, characterizations of new Schiff base heterocyclic derivatives and their optoelectronic, computational studies with level II & III features of LFPs

K Upendranath, T Venkatesh, TN Lohith… - Journal of Molecular …, 2022 - Elsevier
Organic Schiff base compounds with luminous characteristics are receiving attention and
increasing demand for the imaging of latent fingerprints (LFPs) at crime scenes. Sb1 and …

Synthesis, structure–activity relationship and molecular docking of cyclohexenone based analogous as potent non-nucleoside reverse-transcriptase inhibitors

MF Nazar, MI Abdullah, A Badshah, A Mahmood… - Journal of Molecular …, 2015 - Elsevier
The chalcones core in compounds is advantageously chosen effective synthons, which offer
exciting perspectives in biological and pharmacological research. The present study reports …

[HTML][HTML] Synthesis, structure investigation, DFT analysis, optical, and photoelectrical properties of 9-bromo-3-hydroxychromeno [4, 3-b] pyrazolo [4, 3-e] pyridin-5 (1H) …

SA Halim, MA Ibrahim - Results in Chemistry, 2022 - Elsevier
Abstract Chemical transformation of 6-bromochromone-3-carbonitrile (1) with
cyanoacetohydrazide in boiling acetic acid yielded the novel 9-bromo-3 hydroxychromeno …

Synthesis, spectroscopic characterization, and computed optical analysis of green fluorescent cyclohexenone derivatives

MF Nazar, A Badshah, A Mahmood… - Journal of Physical …, 2016 - Wiley Online Library
Cyclohexenone containing chalcones core is one important class of materials, which exhibit
high nonlinear optical (NLO) responses and good crystallizability. The present study reports …