Electrophilicity index revisited

R Pal, PK Chattaraj - Journal of Computational Chemistry, 2023 - Wiley Online Library
This review aims to be a comprehensive, authoritative, critical, and accessible review of
general interest to the chemistry community; because the electrophilicity index is a very …

<? ACS-CT-START-Insert?> Update 2 of:<? ACS-CT-END-Insert?> Electrophilicity Index

PK Chattaraj… - Chemical …, 2011 - ACS Publications
Chemistry is the science of bond making and bond breaking. A thorough knowledge of these
processes in the course of the chemical reaction lies at the heart of any reaction mechanism …

Development of quantitative structure activity relationship (QSAR) model for disinfection byproduct (DBP) research: A review of methods and resources

B Chen, T Zhang, T Bond, Y Gan - Journal of hazardous materials, 2015 - Elsevier
Quantitative structure–activity relationship (QSAR) models are tools for linking chemical
activities with molecular structures and compositions. Due to the concern about the …

Catalyst Design by NH4OH Treatment of USY Zeolite

J Van Aelst, D Verboekend… - Advanced functional …, 2015 - Wiley Online Library
Hierarchical zeolites are a class of superior catalysts which couples the intrinsic zeolitic
properties to enhanced accessibility and intracrystalline mass transport to and from the …

An alkylation route for developing novel liquid aviation fuels from α-pinene and mixed isobutane/isobutene

M Liu, X Zhao, Z Ma, B Yuan, F Yu, C Xie… - Chemical Engineering …, 2023 - Elsevier
As a naturally rigid polycyclic biomass platform compound without oxygen, α-pinene has
always been expected to develop high-energy–density fuel with both good combustion …

Insight into the antioxidant properties of non-phenolic terpenoids contained in essential oils extracted from the buds of Cleistocalyx operculatus: a DFT study

TC Ngo, DQ Dao, NM Thong, PC Nam - RSC advances, 2016 - pubs.rsc.org
The antioxidant properties of 21 non-phenolic terpenoids contained in essential oil extracted
from the buds of Cleistocalyx operculatus have been investigated using density functional …

Synergistic catalysis for converting α-pinene to camphene via carbon-based solid acid derived from eucalyptus wood

T Lv, K Wei, T Wang, X Wang, Z Liu - Molecular Catalysis, 2025 - Elsevier
A carbon-based acid was prepared by the sulfonation of activated carbon derived from
eucalyptus wood waste, a solid waste from wood processing, and characterized by SEM …

Experimental and DFT investigation of surface degradation of polyvinylidene fluoride membrane in alkaline solution

X Zhao, L Song, J Fu, P Tang, F Liu - Surface science, 2011 - Elsevier
The degradation processes of polyvinylidene fluoride (PVDF) membranes in alkaline
solutions were studied using FTIR, FT-Raman, XPS and density functional theory (DFT) …

Biomass transformation: hydration and isomerization reactions of turpentine oil using ion exchange resins as catalyst

VT Salvador, ES Silva, PGC Gonçalves… - Sustainable Chemistry and …, 2020 - Elsevier
The hydration and isomerization of the biomass turpentine have been studied in the
presence of Purolite CT175. The ion exchange resin catalyst was active for hydration and …

MSU-S mesoporous materials: An efficient catalyst for isomerization of α-pinene

J Wang, W Hua, Y Yue, Z Gao - Bioresource technology, 2010 - Elsevier
MSU-S (BEA) and MSU-S (Y) mesoporous molecular sieves with different Si/Al ratios were
prepared and characterized by XRD, XRF, N2 adsorption, 27Al MAS NMR, NH3-TPD and 2 …