Reactivity of substituted seven-membered heterocyclic sulfones: Spectroelectrochemical study and theoretical modeling

L Preda, V Lazarescu, M Hillebrand, E Volanschi - Electrochimica acta, 2006 - Elsevier
The redox behaviour of four arylidene substituted derivatives of dibenz-[b, e]-thiepin-5, 5-
dioxide-11-one was investigated in aprotic media by cyclic voltammetry coupled with …

Comparative study of chalcones and their potential as additives for biofuels

ECM Faria, VS Duarte, RLG de Paula… - Energy & …, 2020 - ACS Publications
The use of fossil fuels represents a large part of the world's energy availability. The burning
of these fuels is related to several global problems. They are nonrenewable sources of …

Designing and Studying Redox-Active Molecules for Energy Storage and Desalination

W Wu - 2023 - digitalcommons.usu.edu
Since the fast growth of the global population, energy scarcity has become a new threat to
modern society. Those commonly seen resources like fossil, coal, and natural gas are …

Theoretical studies of carbonyl-based organic molecules for energy storage applications: the heteroatom and substituent effect

K Hernandez-Burgos, SE Burkhardt… - The Journal of …, 2014 - ACS Publications
Organic compounds represent an attractive choice for cathode materials in rechargeable
lithium batteries. Among all the organic functionalities, carbonyl-based organic molecules (C …

Theoretical Investigation of para Amino-Dichloro Chalcone Isomers. Part II: A DFT Structure–Stability Study of the FMO and NLO Properties

HA Hussein, GF Fadhil - ACS omega, 2023 - ACS Publications
The density functional theory (DFT) method using the functional hybrid (B3LYP) and 6-311G
(d, p) basis set was utilized for the geometry optimization with dispersion correction …

Diamino-Substituted Quinones as Cathodes for Lithium-Ion Batteries

TW Hiltermann, S Sarkar, V Thangadurai… - … Applied Materials & …, 2024 - ACS Publications
This study introduces a sustainable approach to designing organic cathode materials
(OCMs) for lithium-ion batteries as a potential replacement for traditional metal-based …

New Insights into the Substituents' Effect on the Formation and Dissociation of Radical Anions: Dissociative Electron Transfer to Arylsulfonylphthalimides

A Houmam, EM Hamed, MA Saley - ChemElectroChem, 2021 - Wiley Online Library
The electrochemical reduction of a series of biologically relevant p‐substituted
arylsulfonylphthalimides was investigated and the results were analysed using theoretical …

Designing strategies to tune reduction potential of organic molecules for sustainable high capacity battery application

RB Araujo, A Banerjee, P Panigrahi, L Yang… - Journal of Materials …, 2017 - pubs.rsc.org
Organic compounds evolve as a promising alternative to currently used inorganic materials
in rechargeable batteries due to their low-cost, environmental friendliness and flexibility …

Chalcone: A valuable scaffold upgrading by green methods

GP Rosa, AML Seca, MC Barreto… - ACS Sustainable …, 2017 - ACS Publications
Chalcones are naturally occurring α, β-unsaturated carbonyl compounds owning a wide
range of pharmaceutical and industrial applications. They are also key precursors in the …

Electrochemical study and MO—modeling of the reduction behaviour of some arylidene substituted derivatives of dibenz [b, e]-thiepin-5, 5-dioxide-11-one

L Preda, E Volanschi - Open Chemistry, 2009 - degruyter.com
The electrochemical reduction of four arylidene substituted derivatives of dibenz-[b, e]-
thiepin-5, 5-dioxide-11-one has been studied by cyclic voltammetry on platinum (Pt) …