Direct Synthesis of Cyclopropanes from gem-Dialkyl Groups through Double C–H Activation

A Clemenceau, P Thesmar, M Gicquel… - Journal of the …, 2020 - ACS Publications
Cyclopropanes are important structural motifs found in numerous bioactive molecules, and a
number of methods are available for their synthesis. However, one of the simplest …

Game of frontier orbitals: a view on the rational design of novel charge-transfer materials

MV Ivanov, SA Reid, R Rathore - The Journal of Physical …, 2018 - ACS Publications
Since the first application of frontier molecular orbitals (FMOs) to rationalize stereospecificity
of pericyclic reactions, FMOs have remained at the forefront of chemical theory. Yet, the …

Reversible redox processes in polymer of unmetalated salen-type ligand: combined electrochemical in situ studies and direct comparison with corresponding nickel …

J Polozhentseva, M Novozhilova… - International Journal of …, 2022 - mdpi.com
Most non-metalized Salen-type ligands form passivation thin films on electrode surfaces
upon electrochemical oxidation. In contrast, the H2 (3-MeOSalen) forms electroactive …

Hydrostatic pressure on toroidal interaction and propeller chirality of hexaarylbenzenes: explicit solvent effects on differential volumes in methylcyclohexane and …

T Kosaka, S Iwai, G Fukuhara, Y Imai… - Chemistry–A European …, 2019 - Wiley Online Library
A unique and effective interaction between the peripheral aromatic blades makes
hexaarylbenzenes (HABs) attractive in fundamental research as well as for various …

Intramolecular Electron Transfer in Multi‐Redox Systems Based on Cyclic [3] Spirobifluorenylene Compound

T Imai, D Sakamaki, S Aoyagi… - Chemistry–A European …, 2023 - Wiley Online Library
Cyclic [3] spirobifluorenylene with bulky alkyl groups at the ends (1) was designed and
synthesized to investigate the electron transfer phenomena in a π‐conjugated system …

A three-step, gram-scale synthesis of hydroxytyrosol, hydroxytyrosol acetate, and 3, 4-dihydroxyphenylglycol

AD Kalampaliki, V Giannouli, AL Skaltsounis… - Molecules, 2019 - mdpi.com
Hydroxytyrosol and two other polyphenols of olive tree, hydroxytyrosol acetate and 3, 4-
dihydroxyphenylglycol, are known for a wide range of beneficial activities in human health …

Multistate Parabolic Model: A Unified Framework for Understanding Charge Distribution in π-Conjugated Oligomers

MR Talipov, S Brown, J Yan - The Journal of Physical Chemistry C, 2024 - ACS Publications
π-Conjugated oligomers hold great promise for advancing molecular electronics and
photovoltaics due to their distinctive electronic properties. Understanding the charge …

Ask not how many, but where they are: substituents control energetic ordering of frontier orbitals/electronic structures in isomeric methoxy-substituted …

MV Ivanov, MR Talipov, TS Navale… - The Journal of Physical …, 2018 - ACS Publications
Redox properties of polycyclic aromatic hydrocarbons (PAHs) can be modulated by
substitution with electron-rich groups. Here we show, using the example of dibenzo [g, p] …

[HTML][HTML] Xylochemical synthesis of diarylated heterocycles

SB Millar, HN Khachatryan, M Malmir… - Sustainable Chemistry and …, 2024 - Elsevier
The production of (hetero) aromatic fine chemicals heavily relies on base chemicals sourced
from petroleum. The concept of xylochemistry focuses on using compounds derived from …

SARS-CoV-2 Spike Protein Interaction Space

CN Lungu, MV Putz - International Journal of Molecular Sciences, 2023 - mdpi.com
Severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) is a+ sense single-strand
RNA virus. The virus has four major surface proteins: spike (S), envelope (E), membrane …