Works matching DE "ABSTRACTION reactions"

Results: 803

Evaluation of antioxidant properties of lycopene isomers using density functional theory.

Published in:

Journal of Molecular Modeling, 2025, v. 31, n. 7, p. 1, doi. 10.1007/s00894-025-06399-4

By:

Karunarathna, Baggya Sharmali Wickramanayaka;
Gunawardhana, Thashini Kavindiyani;
Gajasinghe, G. M. Supun Tharaka;
Jayakody, Ranga Srinath;
Wanniarachchi, Jayamal Damsith;
Govender, Krishna Kuben

Publication type:

Article

Applications of Benzothiazolines as Hydrogen Atom Donors and Functional Group Transfer Reagents in Organic Synthesis.

Published in:

Asian Journal of Organic Chemistry, 2025, v. 14, n. 7, p. 1, doi. 10.1002/ajoc.202500022

By:

Wang, Fang;
Xie, Xiaoyu;
Wang, Qidi;
Wang, Lei

Publication type:

Article

Hydroboration of phenylmethanimine-borane: synchronicity/nonsynchronicity in a double/single hydrogen transfer reaction.

Published in:

Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2025, v. 144, n. 7, p. 1, doi. 10.1007/s00214-025-03215-3

By:

Fišić, Nikola;
Milovanović, Branislav;
Petković, Milena

Publication type:

Article

Photoinduced Ring‐Opening Functionalization of α‐Imino‐Oxy Acids and Alkanols Enabled by Phthalate‐Derived Proton‐Coupled Electron Transfer Mediator.

Published in:

Chinese Journal of Chemistry, 2025, v. 43, n. 16, p. 1988, doi. 10.1002/cjoc.70074

By:

Tian, Chao;
Shi, Lei

Publication type:

Article

Photolytic activation of Ni(II)X2L explains how Ni-mediated cross coupling begins.

Published in:

Nature Communications, 2025, v. 16, n. 1, p. 1, doi. 10.1038/s41467-025-60729-x

By:

Kudisch, Max;
Hooper, Reagan X.;
Valloli, Lakshmy K.;
Earley, Justin D.;
Zieleniewska, Anna;
Yu, Jin;
DiLuzio, Stephen;
Smaha, Rebecca W.;
Sayre, Hannah;
Zhang, Xiaoyi;
Bird, Matthew J.;
Cordones, Amy A.;
Rumbles, Garry;
Reid, Obadiah G.

Publication type:

Article

Computational Study of Hydrogen Atom Transfer in the Reaction of Quercetin with Hydroxyl Radical.

Published in:

Hydrogen, 2025, v. 6, n. 2, p. 39, doi. 10.3390/hydrogen6020039

By:

Vuzem, David;
Pilepić, Viktor

Publication type:

Article

Transition state structure detection with machine learningś.

Published in:

NPJ Computational Materials, 2025, v. 11, n. 1, p. 1, doi. 10.1038/s41524-025-01693-4

By:

Si, Yitao;
Ma, Yiding;
Yu, Tao;
Wu, Yifan;
Liu, Yingzhe;
Lai, Weipeng;
Zhang, Zhixiang;
Shi, Jinwen;
Guo, Liejin;
Prezhdo, Oleg V.;
Liu, Maochang

Publication type:

Article

Bessie Head, National Economic Development, and the Planning Imagination.

Published in:

Research in African Literatures, 2021, v. 52, n. 3, p. 167, doi. 10.2979/reseafrilite.52.3.09

By:

Horst, Lauren

Publication type:

Article

Macro peroxide initiators based on autoxidized unsaturated plant oils: Block/graft copolymer conjugates for nanotechnology and biomedical applications.

Published in:

Journal of the American Oil Chemists' Society (JAOCS), 2023, v. 100, n. 7, p. 507, doi. 10.1002/aocs.12710

By:

Hazer, Baki

Publication type:

Article

Investigation on the hydrogen abstraction from methyl glucoside by active oxygen species under oxygen delignification conditions IV: appearance of kinetic isotope effect in the reaction between methyl glucoside and deuterated methyl glucoside.

Published in:

Journal of Wood Science, 2012, v. 58, n. 6, p. 563, doi. 10.1007/s10086-012-1289-z

By:

Nakagawa, Akihiko;
Yokoyama, Tomoya;
Matsumoto, Yuji

Publication type:

Article

The Abiotic Nitrite Oxidation by Ligand-Bound Manganese (III): The Chemical Mechanism.

Published in:

Aquatic Geochemistry, 2021, v. 27, n. 3, p. 207, doi. 10.1007/s10498-021-09396-0

By:

Luther III, George W.;
Karolewski, Jennifer S.;
Sutherland, Kevin M.;
Hansel, Colleen M.;
Wankel, Scott D.

Publication type:

Article

Divergent Synthesis of Trifluoromethyl Ketones via Photoredox Activation of Halotrifluoroacetones.

Published in:

Helvetica Chimica Acta, 2024, v. 107, n. 10, p. 1, doi. 10.1002/hlca.202400125

By:

Giri, Rahul;
Kissling, Mathias;
Zhilin, Egor;
Fernandes, Anthony J.;
Ordan, Quentin E. L.;
Katayev, Dmitry

Publication type:

Article

Benzylic C(sp3)−H Azidation: Copper vs Iron Catalysis.

Published in:

Helvetica Chimica Acta, 2024, v. 107, n. 3, p. 1, doi. 10.1002/hlca.202400004

By:

Rentería‐Gómez, Angel;
Torres‐Ochoa, Rubén O.;
Palamini, Pierre;
Simonet‐Davin, Raphaël;
Wang, Qian;
Waser, Jérôme;
Zhu, Jieping

Publication type:

Article

High trans‐2‐Decalones by Photoredox Catalyzed β‐Isomerization.

Published in:

Helvetica Chimica Acta, 2022, v. 105, n. 1, p. 1, doi. 10.1002/hlca.202100180

By:

Sombret, Juliette;
Quintaine, Julie;
Biremond, Tony;
Barnes, Quentin;
de Saint‐Laumer, Jean‐Yves;
Saudan, Lionel

Publication type:

Article

Reactions of Hydroperoxyl Radicals (HO2) with Oxygenated Aromatic Bio-oil Model Compounds.

Published in:

Journal of Computational Biophysics & Chemistry, 2024, v. 23, n. 8, p. 1093, doi. 10.1142/S2737416524500303

By:

Al-Kwradi, Mubarak;
Al-Jefri, Ali Huseein;
Altarawneh, Mohammednoor

Publication type:

Article

Theoretical Exploration of the Antioxidant Activity, Chemopreventive, and Antineoplastic Potentials of Molecules Present in Morinda lucida, Momordica charantia, and Vernonanthura polyanthes.

Published in:

Journal of Computational Biophysics & Chemistry, 2024, v. 23, n. 5, p. 657, doi. 10.1142/S2737416524500108

By:

de Aguiar, Antônio Sérgio Nakao;
da Costa Rodrigues, Lara Lorhany Gomes;
Rocha, Jamira Dias;
Guimarães, Laura Maria Marques;
Ramos, Laysse Cristina Cândida;
Napolitano, Hamilton Barbosa;
Bailão, Elisa Flávia Luiz Cardoso;
Borges, Leonardo Luiz

Publication type:

Article

A Computational Study of the Reactions between Dehydrozingerone Derivatives and the Hydroperoxyl Radical in Aqueous and Lipid Media.

Published in:

Journal of Computational Biophysics & Chemistry, 2021, v. 20, n. 8, p. 829, doi. 10.1142/S2737416521500514

By:

Mansouri, Hadjer;
Mekelleche, Sidi Mohamed

Publication type:

Article

Usnic Acid as a Potential Free Radical Scavenger and its Inhibitory Activity Toward SARS-CoV-2 Proteins.

Published in:

Journal of Computational Biophysics & Chemistry, 2021, v. 20, n. 6, p. 655, doi. 10.1142/S2737416521500393

By:

Jovanović, Jelena Đorović;
Manojlović, Nedeljko;
Marković, Zoran

Publication type:

Article

DFT studies of solvent effect in hydrogen abstraction reactions from different allyl-type monomers with benzoyl radical.

Published in:

BMC Chemistry, 2023, v. 17, n. 1, p. 1, doi. 10.1186/s13065-023-01027-9

By:

Zhao, Xiaotian;
Li, YaMing;
Lin, Shibo;
Liu, Chun;
Guo, Xirui;
Li, Xuanhao;
He, Lihui;
Chen, Xi;
Ye, Guodong

Publication type:

Article

Photochemical synthesis of pyrano[2,3-d]pyrimidine scaffolds using photoexcited organic dye, Na2 eosin Y as direct hydrogen atom transfer (HAT) photocatalyst via visible light-mediated under air atmosphere.

Published in:

BMC Chemistry, 2023, v. 17, n. 1, p. 1, doi. 10.1186/s13065-023-00912-7

By:

Mohamadpour, Farzaneh

Publication type:

Article

Bimetallic FeNi Alloy Nanoparticles Grown on Graphene for Efficient Removal of Congo Red From Aqueous Solution.

Published in:

Advanced Sustainable Systems, 2023, v. 7, n. 3, p. 1, doi. 10.1002/adsu.202200405

By:

Zou, Qiang;
Zhu, Zhenghou;
Yuan, Zhifen

Publication type:

Article

Construction and validation of a detailed gas-phase chemical reaction model for ammonium-dinitramide based ionic liquids.

Published in:

Science & Technology of Energetic Materials, 2020, v. 81, n. 2, p. 53

By:

Noboru Itouyam;
Yu-ichiro Izato;
Atsumi Miyake;
Hiroto Habu

Publication type:

Article

Mechanism of Antiradical Activity of Coumarin-Trihydroxybenzohydrazide Derivatives: A Comprehensive Kinetic DFT Study.

Published in:

Antioxidants, 2024, v. 13, n. 2, p. 143, doi. 10.3390/antiox13020143

By:

Milanović, Žiko;
Dimić, Dušan;
Avdović, Edina H.;
Simijonović, Dušica M.;
Nakarada, Đura;
Jakovljević, Vladimir;
Vojinović, Radiša;
Marković, Zoran S.

Publication type:

Article

Theoretical Study on the Multiple Free Radical Scavenging Reactions of Pyranoanthocyanins.

Published in:

Antioxidants, 2024, v. 13, n. 1, p. 33, doi. 10.3390/antiox13010033

By:

Du, Yapeng;
Chai, Yu;
Zheng, Xiaoping;
Zheng, Yanzhen

Publication type:

Article

Structural Study of a La(III) Complex of a 1,2,3-Triazole Ligand with Antioxidant Activity.

Published in:

Antioxidants, 2023, v. 12, n. 10, p. 1872, doi. 10.3390/antiox12101872

By:

Alcolea Palafox, Mauricio;
Belskaya, Nataliya P.;
Todorov, Lozan T.;
Kostova, Irena P.

Publication type:

Article

Quinoline Derivatives: Promising Antioxidants with Neuroprotective Potential.

Published in:

Antioxidants, 2023, v. 12, n. 10, p. 1853, doi. 10.3390/antiox12101853

By:

Hernández-Ayala, Luis Felipe;
Guzmán-López, Eduardo Gabriel;
Galano, Annia

Publication type:

Article

Exploring the Antioxidant Properties of Caffeoylquinic and Feruloylquinic Acids: A Computational Study on Hydroperoxyl Radical Scavenging and Xanthine Oxidase Inhibition.

Published in:

Antioxidants, 2023, v. 12, n. 9, p. 1669, doi. 10.3390/antiox12091669

By:

Boulebd, Houssem;
Carmena-Bargueño, Miguel;
Pérez-Sánchez, Horacio

Publication type:

Article

To Prevent Oxidative Stress, What about Protoporphyrin IX, Biliverdin, and Bilirubin?

Published in:

Antioxidants, 2023, v. 12, n. 9, p. 1662, doi. 10.3390/antiox12091662

By:

Martínez, Ana;
López-Rull, Isabel;
Fargallo, Juan A.

Publication type:

Article

Combinatorial Interactions of Essential Oils Enriched with Individual Polyphenols, Polyphenol Mixes, and Plant Extracts: Multi-Antioxidant Systems.

Published in:

Antioxidants, 2023, v. 12, n. 2, p. 486, doi. 10.3390/antiox12020486

By:

Nguyen, Marina Minh;
Karboune, Salwa

Publication type:

Article

Calculation of the anharmonic effect on hydrogen abstraction in the combustion mechanism of n‐propylbenzene.

Published in:

Journal of the Chinese Chemical Society, 2024, v. 71, n. 1, p. 45, doi. 10.1002/jccs.202300356

By:

Xu, Shuyang;
Song, Zening;
Hu, Wenye;
Yu, Hongjing;
Yao, Li

Publication type:

Article

Recent advances in total synthesis of natural products by masked ortho‐benzoquinones.

Published in:

Journal of the Chinese Chemical Society, 2022, v. 69, n. 8, p. 1210, doi. 10.1002/jccs.202200276

By:

Chen, Chih‐Ming;
Hsieh, Hsing‐Pang

Publication type:

Article

Hydrogen‐atom tunneling reactions in solid para‐hydrogen and their applications to astrochemistry.

Published in:

Journal of the Chinese Chemical Society, 2022, v. 69, n. 8, p. 1159, doi. 10.1002/jccs.202200210

By:

Haupa, Karolina Anna;
Joshi, Prasad Ramesh;
Lee, Yuan‐Pern

Publication type:

Article

Novel phenolic compounds by DFT: Electronic effects on antioxidant activity of 4‐vinylphenol derivatives.

Published in:

Journal of the Chinese Chemical Society, 2021, v. 68, n. 5, p. 817, doi. 10.1002/jccs.202000501

By:

Mohebi, Nazanin;
Kassaee, Mohamad Z.

Publication type:

Article

Novel silylphenol antioxidants by density functional theory.

Published in:

Journal of the Chinese Chemical Society, 2020, v. 67, n. 11, p. 1986, doi. 10.1002/jccs.202000131

By:

Ayoubi‐Chianeh, Mojgan;
Kassaee, Mohamad Z.

Publication type:

Article

Cover Picture: Journal of the Chinese Chemical Society 5/2015.

Published in:: Journal of the Chinese Chemical Society, 2015, v. 62, n. 5, p. n/a, doi. 10.1002/jccs.201590013
Publication type:: Article

Unexpected activity of MgO nanoclusters for the reductive-coupling synthesis of organonitrogen chemicals with C = N bonds.

Published in:

Nature Communications, 2025, v. 16, n. 1, p. 1, doi. 10.1038/s41467-025-58222-6

By:

Yuan, Ziliang;
Han, Bo;
Liu, Bing;
Sun, Jie;
Zhou, Peng;
Mu, Rentao;
Zhang, Zehui

Publication type:

Article

Ground-state flavin-dependent enzymes catalyzed enantioselective radical trifluoromethylation.

Published in:

Nature Communications, 2025, v. 16, n. 1, p. 1, doi. 10.1038/s41467-025-56437-1

By:

Duan, Xinyu;
Cui, Dong;
Wang, Mengdi;
Jin, Chenlu;
Cai, Xiaochen;
Wang, Zhiguo;
Xu, Jian

Publication type:

Article

Carbon-carbon triple bond cleavage and reconstitution to achieve aryl amidation using nitrous acid esters.

Published in:

Nature Communications, 2025, v. 16, n. 1, p. 1, doi. 10.1038/s41467-025-56370-3

By:

Wang, Zi-Ying;
Wang, Shoujun;
Dai, Nan-Nan;
Xiao, Yao;
Zhou, Yu;
Tian, Wen-Chan;
Sun, Dongru;
Li, Qiang;
Wang, Yong;
Wei, Wen-Ting

Publication type:

Article

Catalytic acceptorless complete dehydrogenation of cycloalkanes.

Published in:

Nature Communications, 2025, v. 16, n. 1, p. 1, doi. 10.1038/s41467-024-55460-y

By:

Jagtap, Rahul A.;
Nishioka, Yuki;
Geddis, Stephen M.;
Irie, Yu;
Takanashi, Tsukasa;
Adachi, Rintaro;
Yamakata, Akira;
Fuki, Masaaki;
Kobori, Yasuhiro;
Mitsunuma, Harunobu;
Kanai, Motomu

Publication type:

Article

The degradation mechanism of multi-resonance thermally activated delayed fluorescence materials.

Published in:

Nature Communications, 2025, v. 16, p. 1, doi. 10.1038/s41467-024-55620-0

By:

Jhun, Byung Hak;
Park, Yerin;
Kim, Hwang Suk;
Baek, Ji Hye;
Kim, Joonghyuk;
Lee, Eunji;
Moon, Hyejin;
Oh, Changjin;
Jung, Yongsik;
Choi, Seunghee;
Baik, Mu-Hyun;
You, Youngmin

Publication type:

Article

Shuttle HAT for mild alkene transfer hydrofunctionalization.

Published in:

Nature Communications, 2024, v. 15, n. 1, p. 1, doi. 10.1038/s41467-024-53281-7

By:

Jankins, Tanner C.;
Blank, Philip M.;
Brugnetti, Andrea;
Boehm, Philip;
Aouane, Françoise A.;
Morandi, Bill

Publication type:

Article

Energy transfer-mediated multiphoton synergistic excitation for selective C(sp3)–H functionalization with coordination polymer.

Published in:

Nature Communications, 2024, v. 15, n. 1, p. 1, doi. 10.1038/s41467-024-53115-6

By:

Wang, Zhonghe;
Tang, Yang;
Liu, Songtao;
Zhao, Liang;
Li, Huaqing;
He, Cheng;
Duan, Chunying

Publication type:

Article

Pressure-induced generation of heterogeneous electrocatalytic metal hydride surfaces for sustainable hydrogen transfer.

Published in:

Nature Communications, 2024, v. 15, n. 1, p. 1, doi. 10.1038/s41467-024-52228-2

By:

Luo, Laihao;
Liu, Xinyan;
Zhao, Xinyu;
Zhang, Xinyan;
Peng, Hong-Jie;
Ye, Ke;
Jiang, Kun;
Jiang, Qiu;
Zeng, Jie;
Zheng, Tingting;
Xia, Chuan

Publication type:

Article

Harnessing the potential of acyl triazoles in bifunctional cobalt-catalyzed radical cross-coupling reactions.

Published in:

Nature Communications, 2024, v. 15, n. 1, p. 1, doi. 10.1038/s41467-024-51376-9

By:

Tan, Chang-Yin;
Hong, Sungwoo

Publication type:

Article

Site-selective α-C(sp3)–H arylation of dialkylamines via hydrogen atom transfer catalysis-enabled radical aryl migration.

Published in:

Nature Communications, 2024, v. 15, n. 1, p. 1, doi. 10.1038/s41467-024-51239-3

By:

Xu, Jie;
Li, Ruihan;
Ma, Yijian;
Zhu, Jie;
Shen, Chengshuo;
Jiang, Heng

Publication type:

Article

C(sp3)–H sulfinylation of light hydrocarbons with sulfur dioxide via hydrogen atom transfer photocatalysis in flow.

Published in:

Nature Communications, 2024, v. 15, n. 1, p. 1, doi. 10.1038/s41467-024-49322-w

By:

Nagornîi, Dmitrii;
Raymenants, Fabian;
Kaplaneris, Nikolaos;
Noël, Timothy

Publication type:

Article

Sulfonamide-directed site-selective functionalization of unactivated C(sp3)−H enabled by photocatalytic sequential electron/proton transfer.

Published in:

Nature Communications, 2024, v. 15, n. 1, p. 1, doi. 10.1038/s41467-024-49337-3

By:

Wang, Chaodong;
Chen, Zhi;
Sun, Jie;
Tong, Luwei;
Wang, Wenjian;
Song, Shengjie;
Li, Jianjun

Publication type:

Article

Unusual reaction pathways of gallium(III) silylamide complexes.

Published in:

Main Group Metal Chemistry, 2013, v. 36, n. 5/6, p. 169, doi. 10.1515/mgmc-2013-0039

By:

König, Sonja N.;
Gerstberger, Gisela;
Schädle, Christoph;
Maichle-Mössmer, Cäcilia;
Herdtweck, Eberhardt;
Anwander, Reiner

Publication type:

Article

Developing antioxidant of gold nanofilm by a facile electrodeposition method.

Published in:

Journal of Advanced Pharmaceutical Technology & Research, 2024, v. 15, n. 4, p. 320, doi. 10.4103/JAPTR.JAPTR_138_24

By:

Budi, Setia;
Suliasih, Babay Asih;
Fikri, Ibrahim Dhuafa;
Afrizal;
Angelina, Marissa

Publication type:

Article

Reactions of MoCl5 and MoO2Cl2 with Succinimide, 1,4-Diaminobutane, 3-Methylpyridine, 1,3-Diaminopropane, Pyrazole and 1-Methylpyrrolidine in Tetrahydrofuran.

Published in:

Oriental Journal of Chemistry, 2021, v. 37, n. 3, p. 553, doi. 10.13005/ojc/370316

By:

KUMAR, RAKESH;
SINGH, GURSHARAN

Publication type:

Article