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Published in 2018 at "Journal of Molecular Modeling"
DOI: 10.1007/s00894-018-3604-0
Abstract: AbstractThe applicability of C44, B22N22, Ge44, and Al22P22 nanocages, as well as variants of those nanocages with an adsorbed halogen atom, as high-performance anode materials in Li-ion, Na-ion, and K-ion batteries was investigated theoretically via…
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Keywords:
ion;
ion batteries;
metal ion;
halogen atom ... See more keywords
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Published in 2022 at "Organic Letters"
DOI: 10.1021/acs.orglett.2c02840
Abstract: Indoles are among the most important N-heterocycles in pharmaceuticals. Here, we present an alternative to the classic Fischer indole synthesis based on the radical coupling between aryl diazoniums and alkyl iodides. This iron-mediated strategy features…
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Keywords:
indole synthesis;
halogen atom;
alkyl iodides;
atom transfer ... See more keywords
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Published in 2023 at "Organic letters"
DOI: 10.1021/acs.orglett.3c00358
Abstract: A halogen-atom transfer (XAT) strategy utilizing α-aminoalkyl radicals allows the generation of aryl radicals at room temperature, which is applied for intramolecular cyclization reactions en route to biologically relevant alkaloids. Starting from simple halogen-substituted benzamides…
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Keywords:
halogen;
halogen atom;
transfer;
atom transfer ... See more keywords
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Published in 2021 at "Journal of the American Chemical Society"
DOI: 10.1021/jacs.1c06768
Abstract: We report here a mechanistically distinct tactic to carry E2-type eliminations on alkyl halides. This strategy exploits the interplay of α-aminoalkyl radical-mediated halogen-atom transfer (XAT) with desaturative cobalt catalysis. The methodology is high-yielding, tolerates many…
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Keywords:
alkyl halides;
atom transfer;
contra thermodynamic;
transfer xat ... See more keywords
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Published in 2022 at "Journal of the American Chemical Society"
DOI: 10.1021/jacs.2c05356
Abstract: The application of abundant and inexpensive fluorine feedstock sources to synthesize fluorinated compounds is an appealing yet underexplored strategy. Here, we report a photocatalytic radical hydrodifluoromethylation of unactivated alkenes with an inexpensive industrial chemical, chlorodifluoromethane…
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Keywords:
halogen atom;
atom;
tertiary amine;
atom transfer ... See more keywords
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Published in 2019 at "Journal of the American Chemical Society"
DOI: 10.1021/jacs.8b13499
Abstract: Ni(I)-mediated single-electron oxidative activation of alkyl halides has been extensively proposed as a key step in Ni-catalyzed cross-coupling reactions to generate radical intermediates. There are four mechanisms through which this step could take place: oxidative…
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Keywords:
atom abstraction;
mediated alkyl;
electron transfer;
halogen atom ... See more keywords
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Published in 2021 at "Nature Catalysis"
DOI: 10.1038/s41929-021-00652-8
Abstract: Despite the fact that nucleophilic displacement (SN2) of alkyl halides with nitrogen nucleophiles is one of the first reactions introduced in organic chemistry teaching, its practical utilization is largely limited to unhindered (primary) or activated…
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Keywords:
alkyl;
atom transfer;
alkyl iodides;
chemistry ... See more keywords
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1
Published in 2022 at "Chemical Science"
DOI: 10.1039/d2sc02732a
Abstract: Ketyl–olefin coupling reactions stand as one of the fundamental chemical transformations in synthetic chemistry and have been widely employed in the generation of complex molecular architectures and natural product synthesis. However, catalytic ketyl–olefin coupling, until…
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Keywords:
ketyl olefin;
olefin coupling;
halogen atom;
chemistry ... See more keywords
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Published in 2022 at "Science"
DOI: 10.1126/science.abq8663
Abstract: The generation of carbon radicals by halogen-atom and group transfer reactions is generally achieved using tin and silicon reagents that maximize the interplay of enthalpic (thermodynamic) and polar (kinetic) effects. In this work, we demonstrate…
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Keywords:
halogen atom;
carbon;
atom group;
atom ... See more keywords