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DFT study on the reaction mechanisms and stereoselectivities of NHC-catalyzed [2 + 2] cycloaddition between arylalkylketenes and electron-deficient benzaldehydes

Org. and Biomol. Chem. - 6 August, 2014 - 13:54

Org. Biomol. Chem., 2014, 12,6374-6383
DOI: 10.1039/C4OB00606B, PaperMengmeng Zhang, Donghui Wei, Yang Wang, Suiji Li, Jiefei Liu, Yanyan Zhu, Mingsheng Tang
Two possible mechanisms of ketene and aldehyde [2 + 2] cycloaddition catalyzed by NHC have been investigated using the DFT method.
The content of this RSS Feed (c) The Royal Society of Chemistry

A New Tetracyclic Lactam Building Block for Thick, Broad-Bandgap Photovoltaics

J. Am. Chem. Soc. - 6 August, 2014 - 13:41

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Journal of the American Chemical SocietyDOI: 10.1021/ja5051692

Binding Mode Investigations on the Interaction of Lead(II) Acetate with Human Chorionic Gonadotropin

J. Phys. Chem. B - 6 August, 2014 - 12:25

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The Journal of Physical Chemistry BDOI: 10.1021/jp505565s

A Well-Defined Terminal Vanadium(III) Oxo Complex

Inorganic Chemistry - 6 August, 2014 - 12:04

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Inorganic ChemistryDOI: 10.1021/ic5010177

B-Cation Order Control of Magnetism in the 1322 Perovskite CaCu3Fe2Nb2O12

Chem. Mat. - 6 August, 2014 - 11:22

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Chemistry of MaterialsDOI: 10.1021/cm502064b

Mechanisms for CO oxidation on Fe(III)-OH-Pt interface: a DFT study

Faraday Disc. - 6 August, 2014 - 11:17
Faraday Discuss., 2014, Accepted Manuscript
DOI: 10.1039/C4FD00144C, PaperGang Fu, Nanfeng Zheng, Guangxu Chen, Yun Zhao
The full catalytic cycle that involves the oxidation of two CO molecules is investigated here by using periodic density functional calculation. To simulate the nature of Fe(OH)x/Pt nanoparticles, three possible...
The content of this RSS Feed (c) The Royal Society of Chemistry

pH-Responsive Magnetic Core–Shell Nanocomposites for Drug Delivery

Langmuir - 6 August, 2014 - 11:09

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LangmuirDOI: 10.1021/la501833u

An Organic Spin Crossover Material in Water from a Covalently Linked Radical Dyad

J. Org. Chem. - 6 August, 2014 - 11:08

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The Journal of Organic ChemistryDOI: 10.1021/jo5012812

Plasmonic Nanoclocks

Nanoletters - 5 August, 2014 - 20:26

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Nano LettersDOI: 10.1021/nl501997z

Lubrication by Polyelectrolyte Brushes

Macromolecules - 5 August, 2014 - 20:12

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MacromoleculesDOI: 10.1021/ma500772a

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