Works matching Reaction Mechanisms

Results: 5000

Analysis of undergraduate chemistry students' responses to substitution reaction mechanisms: a road to mastery.

Published in:

Chemistry Teacher International, 2024, v. 6, n. 3, p. 231, doi. 10.1515/cti-2023-0075

By:

Nartey, Esther;
Koranteng, Ernest;
Oppong, Emmanuel Kyame;
Hanson, Ruby

Publication type:

Article

Students' & Faculty Members' Attitudes Towards Learning and Teaching Reaction Mechanisms in Organic Chemistry.

Published in:

Education Sciences, 2025, v. 15, n. 3, p. 357, doi. 10.3390/educsci15030357

By:

Odeleye, Oluwatobi;
Tieu, Nghiem

Publication type:

Article

Computational Insights into the Reaction Mechanisms of Nickel‐Catalyzed Hydrofunctionalizations and Nickel‐Dependent Enzymes.

Published in:

Asian Journal of Organic Chemistry, 2018, v. 7, n. 3, p. 522, doi. 10.1002/ajoc.201700645

By:

Zhang, Tonghuan;
Zhang, Xiaoyong;
Chung, Lung Wa

Publication type:

Article

Theoretical study on mechanism of reaction between <italic>tert</italic>-butyl isocyanide and dimethyl acetylenedicarboxylate in presence of ethanethiol or thiophenol.

Published in:

Research on Chemical Intermediates, 2018, v. 44, n. 4, p. 2653, doi. 10.1007/s11164-018-3252-0

By:

Zakarianezhad, Mohammad;
Makiabadi, Batoul;
Habibi-Khorassani, Sayyed Mostafa;
Shool, Motahareh;
Eslamlou, Masoomeh

Publication type:

Article

Radiation Chemistry Reveals the Reaction Mechanisms Involved in the Reduction of Vinylene Carbonate in the Solid Electrolyte Interphase of Lithium‐Ion Batteries.

Published in:

ChemSusChem, 2025, v. 18, n. 8, p. 1, doi. 10.1002/cssc.202402091

By:

Souid, Yanis;
Puget, Marin;
Ortiz, Daniel;
Piveteau, Laura;
Denisov, Sergey;
Herlin‐Boime, Nathalie;
Mostafavi, Mehran;
Dognon, Jean‐Pierre;
Le Caër, Sophie

Publication type:

Article

NUMERICAL STUDY OF THE COMBUSTION OF CONVENTIONAL AND BIOFUELS USING REDUCED AND ADVANCED REACTION MECHANISMS.

Published in:

Thermal Science, 2015, v. 19, n. 6, p. 2171, doi. 10.2298/TSCI141106038A

By:

ABDALLA, Ibrahim E.;
ALAJMI, Ayedh;
Zhiyin YANG

Publication type:

Article

A verification of the reaction mechanism of direct carbon solid oxide fuel cells.

Published in:

Journal of Solid State Electrochemistry, 2013, v. 17, n. 1, p. 121, doi. 10.1007/s10008-012-1866-5

By:

Xie, Yongmin;
Tang, Yubao;
Liu, Jiang

Publication type:

Article

Sodium Arenesulfinates‐Involved Sulfinate Synthesis Revisited: Improved Synthesis and Revised Reaction Mechanism.

Published in:

European Journal of Organic Chemistry, 2019, v. 2019, n. 8, p. 1846, doi. 10.1002/ejoc.201900097

By:

Ji, Yuan‐Zhao;
Li, Hui‐Jing;
Zhang, Jin‐Yu;
Wu, Yan‐Chao

Publication type:

Article

Reaction mechanism and kinetics of the mercury solid waste pyrolysis: An isoconversional approach.

Published in:

Journal of Solid Waste Technology & Management, 2016, v. 42, n. 1, p. 897

By:

Busto, Yailen;
Palacios, Edesmin W.;
Tack, Filip M. G.;
Peralta, Luis M.;
Arteaga, Luis E.;
de la C. Yera, Miriam

Publication type:

Article

Mercury Methylation by Cobalt Corrinoids: Relativistic Effects Dictate the Reaction Mechanism.

Published in:

Angewandte Chemie International Edition, 2016, v. 55, n. 38, p. 11503, doi. 10.1002/anie.201606001

By:

Demissie, Taye B.;
Garabato, Brady D.;
Ruud, Kenneth;
Kozlowski, Pawel M.

Publication type:

Article

Electron Flow in Reaction Mechanisms-Revealed from First Principles.

Published in:

Angewandte Chemie International Edition, 2015, v. 54, n. 18, p. 5518, doi. 10.1002/anie.201410637

By:

Knizia, Gerald;
Klein, Johannes E. M. N.

Publication type:

Article

An Introduction to the Lump Kinetics Model and Reaction Mechanism of FCC Gasoline.

Published in:

Energy Sources Part A: Recovery, Utilization & Environmental Effects, 2013, v. 35, n. 20, p. 1921, doi. 10.1080/15567036.2010.531508

By:

Kang, X.;
Guo, X.;
You, H.

Publication type:

Article

Protonation states of intermediates in the reaction mechanism of [NiFe] hydrogenase studied by computational methods.

Published in:

Journal of Biological Inorganic Chemistry (JBIC), 2016, v. 21, n. 3, p. 383, doi. 10.1007/s00775-016-1348-9

By:

Dong, Geng;
Ryde, Ulf

Publication type:

Article

Analysis of Active Ion-Leaching Behavior and the Reaction Mechanism During Alkali Activation of Low-Calcium Fly Ash.

Published in:

International Journal of Concrete Structures & Materials, 2018, v. 12, n. 1, p. 1, doi. 10.1186/s40069-018-0282-3

By:

Yin, Bo;
Kang, Tianhe;
Kang, Jianting;
Chen, Yuejuan

Publication type:

Article

First-order parallel and consecutive reaction mechanisms — Isosbestic points criterium.

Published in:

Canadian Journal of Chemistry, 2008, v. 86, n. 9, p. 918, doi. 10.1139/V08-098

By:

Croce, A. E.

Publication type:

Article

Reaction mechanism of O-acylhydroxamate with cysteine proteases.

Published in:

Journal of Chemical Sciences, 2007, v. 119, n. 5, p. 533, doi. 10.1007/s12039-007-0067-8

By:

Shankar, R.;
Kolandaivel, P.

Publication type:

Article

Study on the Reaction Mechanism for Soot Oxidation Over TiO2 or ZrO2-supported Vanadium Oxide Catalysts by Means of In-situ UV-Raman.

Published in:

Catalysis Letters, 2008, v. 120, n. 1/2, p. 148, doi. 10.1007/s10562-007-9267-6

By:

Jian Liu;
Zhen Zhao;
Peng Liang;
Chunming Xu;
Aijun Duan;
Guiyuan Jiang;
Wenyong Lin;
Wachs, Israel

Publication type:

Article

A detailed reaction mechanism for elemental sulphur combustion in the furnace of sulphuric acid plants.

Published in:

Canadian Journal of Chemical Engineering, 2021, v. 99, n. 11, p. 2441, doi. 10.1002/cjce.24185

By:

Abumounshar, Najah Mahmoud;
Ibrahim, Salisu;
Raj, Abhijeet

Publication type:

Article

A new reduced reaction mechanism of a surrogate fuel for kerosene.

Published in:

Canadian Journal of Chemical Engineering, 2013, v. 91, n. 3, p. 483, doi. 10.1002/cjce.21674

By:

ZENg, WEN;
Liu, Jing ‐ chEN;
ChEN, Xiao ‐ Xiao;
Ma, Hong ‐ An

Publication type:

Article

Steam Reforming of Methane Over Nickel: Development of a Multi-Step Surface Reaction Mechanism.

Published in:

Topics in Catalysis, 2011, v. 54, n. 13-15, p. 845, doi. 10.1007/s11244-011-9702-1

By:

Maier, L.;
Schädel, B.;
Herrera Delgado, K.;
Tischer, S.;
Deutschmann, O.

Publication type:

Article

Modeling the transition state structure to probe a reaction mechanism on the oxidation of quinoline by quinoline 2-oxidoreductase.

Published in:

Chemistry Central Journal, 2016, v. 10, n. 1, p. 1, doi. 10.1186/s13065-016-0219-3

By:

Bayle, Enyew

Publication type:

Article

Some Studies to Establish the Reaction Mechanism for the Reduction of Iron Ore-Graphite Composite Pellets in a Packed Bed Reactor.

Published in:

Steel Research International, 2010, v. 81, n. 11, p. 925, doi. 10.1002/srin.201000120

By:

Chowdhury, G. M.;
Murmu, C. S.;
Roy, S. K.;
Roy, G. G.

Publication type:

Article

Mechanism of the Oxidative Ring-Closure Reaction during Gliotoxin Biosynthesis by Cytochrome P450 GliF.

Published in:

International Journal of Molecular Sciences, 2024, v. 25, n. 16, p. 8567, doi. 10.3390/ijms25168567

By:

Qureshi, Muizz;
Mokkawes, Thirakorn;
Cao, Yuanxin;
de Visser, Sam P.

Publication type:

Article

Reproducing Reaction Mechanisms with Machine‐Learning Models Trained on a Large‐Scale Mechanistic Dataset.

Published in:

Angewandte Chemie, 2024, v. 136, n. 43, p. 1, doi. 10.1002/ange.202411296

By:

Joung, Joonyoung F.;
Fong, Mun Hong;
Roh, Jihye;
Tu, Zhengkai;
Bradshaw, John;
Coley, Connor W.

Publication type:

Article

Development and psychometric analysis of an inventory of fundamental concepts for understanding organic reaction mechanisms.

Published in:

Chemistry Teacher International, 2021, v. 3, n. 4, p. 377, doi. 10.1515/cti-2021-0009

By:

Nedungadi, Sachin;
Mosher, Michael D.;
Paek, Sue Hyeon;
Hyslop, Richard M.;
Brown, Corina E.

Publication type:

Article

Temperature response of Rubisco kinetics in Arabidopsis thaliana: thermal breakpoints and implications for reaction mechanisms.

Published in:

Journal of Experimental Botany, 2019, v. 70, n. 1, p. 231, doi. 10.1093/jxb/ery355

By:

Boyd, Ryan A;
Cavanagh, Amanda P;
Kubien, David S;
Cousins, Asaph B

Publication type:

Article

Theoretical study on reaction mechanism of isocyanate radical NCO with ethene.

Published in:

International Journal of Quantum Chemistry, 2009, v. 109, n. 4, p. 801, doi. 10.1002/qua.21877

By:

Pang, Jing‐Lin;
Xie, Hong‐Bin;
Zhang, Shao‐Wen;
Ding, Yi‐Hong;
Tang, Ao‐Qing

Publication type:

Article

Theoretical study of the mechanism of CH2CO + CN reaction.

Published in:

International Journal of Quantum Chemistry, 2006, v. 106, n. 4, p. 894, doi. 10.1002/qua.20780

By:

Sun, Hao;
He, Hong‐Qing;
Hong, Bo;
Chang, Ying‐Fei;
An, Zhe;
Wang, Rong‐Shun

Publication type:

Article

Theoretical study on the reaction mechanism and thermodynamics of tin oxidation by oxygen species and chlorine species.

Published in:

International Journal of Quantum Chemistry, 2005, v. 104, n. 3, p. 367, doi. 10.1002/qua.20570

By:

Li, Lai‐Cai;
Deng, Ping;
Zhu, Yuan‐Qiang;
Zha, Dong;
Tian, An‐Min;
Xu, Ming‐Hou;
Wong, Ning‐Bew

Publication type:

Article

Combined DFT, QCISD(T), and G2 mechanism investigation for the reactions of carbon monophosphide CP with unsaturated hydrocarbons allene CH2CCH2 and methylacetylene CH3CCH.

Published in:

Journal of Computational Chemistry, 2007, v. 28, n. 7, p. 1221, doi. 10.1002/jcc.20611

By:

Zhao Yan-Li;
Wei Kan;
Hua Zhong;
Hai-Tao Yu;
Hong-Gang Fu

Publication type:

Article

The reaction mechanism of iron and manganese superoxide dismutases studied by theoretical calculations.

Published in:

Journal of Computational Chemistry, 2006, v. 27, n. 12, p. 1398, doi. 10.1002/jcc.20450

By:

Rulíšek, Lubomír;
Jensen, Kasper P.;
Lundgren, Kristoffer;
Ryde, Ulf

Publication type:

Article

Environmental remediation processes by zero valence copper: reaction mechanisms.

Published in:

Environmental Science & Pollution Research, 2019, v. 26, n. 15, p. 14883, doi. 10.1007/s11356-019-04989-3

By:

de Sousa, Paloma Viana Ferreira;
de Oliveira, André Fernando;
da Silva, Antônio Alberto;
Lopes, Renata Pereira

Publication type:

Article

Using the Relative Energy Gradient Method with Interacting Quantum Atoms to Determine the Reaction Mechanism and Catalytic Effects in the Peptide Hydrolysis in HIV‐1 Protease.

Published in:

Chemistry - A European Journal, 2018, v. 24, n. 43, p. 11200, doi. 10.1002/chem.201802035

By:

Thacker, Joseph C. R.;
Vincent, Mark A.;
Popelier, Paul L. A.

Publication type:

Article

Insights into the Reaction Mechanism of Catalytic Wet Air Oxidation of Ammonia Over Bimetallic Ru-Cu Catalyst.

Published in:

Topics in Catalysis, 2018, v. 61, n. 15-17, p. 1684, doi. 10.1007/s11244-018-1019-x

By:

Fu, Jile;
Xiao, Dewei;
Yue, Qingqing;
Geng, Lili;
Fasan, Paul Oluwaseyi;
Zhang, Nuowei;
Zheng, Jinbao;
Chen, Bing H.

Publication type:

Article

Reaction mechanism of CHM≡MCH (M=C, Si, Ge) with CH: [2+1] or [2+2] cycloaddition?

Published in:

Journal of Molecular Modeling, 2013, v. 19, n. 9, p. 3501, doi. 10.1007/s00894-013-1882-0

By:

Huo, Suhong;
Li, Xiaoyan;
Zeng, Yanli;
Zheng, Shijun;
Meng, Lingpeng

Publication type:

Article

A DFT study on the mechanisms for the cycloaddition reactions between 1−aza-2-azoniaallene cations and acetylenes.

Published in:

Journal of Molecular Modeling, 2013, v. 19, n. 1, p. 83, doi. 10.1007/s00894-012-1521-1

By:

Wang, Jing-mei;
Li, Zhi-ming;
Wang, Quan-rui;
Tao, Feng-gang

Publication type:

Article

Theoretical studies on reaction mechanism of H with COS.

Published in:

Journal of Molecular Modeling, 2010, v. 16, n. 12, p. 1911, doi. 10.1007/s00894-010-0686-8

By:

Zhang, Riguang;
Ling, Lixia;
Wang, Baojun

Publication type:

Article

Study on the Reaction Mechanism of Potassium Titanate Fibers.

Published in:

Integrated Ferroelectrics, 2014, v. 153, n. 1, p. 156, doi. 10.1080/10584587.2014.903132

By:

Ji, Xiaoli;
Wu, Shijiang;
Zhang, Song;
Zhao, Xiujian

Publication type:

Article

Theoretical investigation on the reaction mechanism of CF3OCHF2 + O(1D).

Published in:

Molecular Physics, 2011, v. 109, n. 3, p. 373, doi. 10.1080/00268976.2010.524170

By:

Yu, Yan-Bo;
Jia, Xiu-Juan;
Gao, Yang;
Song, Gui-Cai;
Luo, Jie;
Wang, Rong-Shun;
Pan, Xiu-Mei

Publication type:

Article

Monitoring the Reaction Mechanism in Model Biogas Reforming by In Situ Transient and Steady-State DRIFTS Measurements.

Published in:

ChemSusChem, 2017, v. 10, n. 6, p. 1193, doi. 10.1002/cssc.201601379

By:

Bobadilla, Luis F.;
Garcilaso, Victoria;
CENtENo, Miguel A.;
Odriozola, José A.

Publication type:

Article

Theoretical study on the gas-phase reaction mechanism of ammonia with nitrous oxide.

Published in:

Journal of Molecular Modeling, 2020, v. 26, n. 3, p. 1, doi. 10.1007/s00894-020-4291-1

By:

Li, Yuyan;
Jiang, Rongpei;
Xu, Sen;
Gong, Xuedong;
Pan, Feng;
Pang, Aimin

Publication type:

Article

Reaction mechanism of organoselenium-catalyzed <italic>syn</italic>-dichlorination of alkenes: a DFT study.

Published in:

Journal of Molecular Modeling, 2018, v. 24, n. 4, p. 1, doi. 10.1007/s00894-018-3624-9

By:

Fu, Lijun;
Mu, Xueli;
Li, Baiqing

Publication type:

Article

A theoretical study on the mechanism of the reaction between azacyclopropenylidene and oxirane.

Published in:

Journal of the Serbian Chemical Society, 2015, v. 80, n. 1, p. 53, doi. 10.2298/JSC140509056J

By:

YING JING;
XIAOJUN TAN

Publication type:

Article

Theoretical Study of ClOO + NO Reaction: Mechanism and Kinetics.

Published in:

Molecules, 2017, v. 22, n. 12, p. 2121, doi. 10.3390/molecules22122121

By:

Nan-Nan Wu;
Shun-Li Ou-Yang;
Liang Li

Publication type:

Article

The Morita-Baylis-Hillman Reaction: Insights into Asymmetry and Reaction Mechanisms by Electrospray Ionization Mass Spectrometry.

Published in:

Molecules, 2009, v. 14, n. 10, p. 3989, doi. 10.3390/molecules14103989

By:

Carrasco-Sanchez, Verónica;
Simirgiotis, Mario J.;
Santos, Leonardo S.

Publication type:

Article

Quantum Chemical Study of Mechanisms of Organic Reactions: X. Reaction of Dipotassium Propane-1,3-bis(thiolate) with 1,3-Dichloropropene in the System Hydrazine Hydrate–KOH.

Published in:

Russian Journal of Organic Chemistry, 2021, v. 57, n. 7, p. 1073, doi. 10.1134/S1070428021070071

By:

Chirkina, E. A.;
Krivdin, L. B.;
Nikonova, V. S.;
Grabelnykh, V. A.;
Korchevin, N. A.;
Rosenzweig, I. B.

Publication type:

Article

A QM/MM study of the associative mechanism for the phosphorylation reaction catalyzed by protein kinase A and its D166A mutant.

Published in:

Journal of Computer-Aided Molecular Design, 2014, v. 28, n. 11, p. 1077, doi. 10.1007/s10822-014-9786-3

By:

Pérez-Gallegos, Ayax;
Garcia-Viloca, Mireia;
González-Lafont, Àngels;
Lluch, José

Publication type:

Article

Theoretical study on the reaction mechanisms of CH3ONO with F, Cl and Br atoms.

Published in:

Progress in Reaction Kinetics & Mechanism, 2016, v. 41, n. 2, p. 135, doi. 10.3184/146867816X14634123524251

By:

Wang, Lu;
Du, Chong-Yang;
Cui, Xiang-Yang;
Zheng, Xiao-Wen;
Liu, Tao

Publication type:

Article

Investigation of the Reaction Mechanism for the Epoxidation of Alkenes with Hydrogen Peroxide Catalyzed by a Protonated Tetranuclear Peroxotungstate with NMR Spectroscopy, Kinetics, and DFT Calculations.

Published in:

European Journal of Inorganic Chemistry, 2013, v. 2013, n. 10/11, p. 1943, doi. 10.1002/ejic.201201058

By:

Ishimoto, Ryo;
Kamata, Keigo;
Mizuno, Noritaka

Publication type:

Article

Theoretical study on the reaction mechanism of vinyl acetate with OH radicals in the atmosphere.

Published in:

Canadian Journal of Chemistry, 2013, v. 91, n. 4, p. 241, doi. 10.1139/cjc-2012-0294

By:

Zhao, Yan;
Sun, Haitao;
Wang, Renjun;
Gao, Fei

Publication type:

Article