Theoretical analysis of the regio- and stereoselective synthesis of spiroisoxazolines
Journal of Molecular Modeling, ISSN: 0948-5023, Vol: 26, Issue: 6, Page: 117
2020
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Example: if you select the 1-year option for an article published in 2019 and a metric category shows 90%, that means that the article or review is performing better than 90% of the other articles/reviews published in that journal in 2019. If you select the 3-year option for the same article published in 2019 and the metric category shows 90%, that means that the article or review is performing better than 90% of the other articles/reviews published in that journal in 2019, 2018 and 2017.
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Article Description
The [3+2] cycloaddition (32CA) reaction of benzonitrile oxide to α-methylene cyclopentanone and propionitrile oxide to γ-methyl-α-methylene-γ-butyrolactone, yielding regio- and stereochemically defined spiroisoxazolines, has been studied at the MPWB1K/6-311G(d,p) computational level. These processes proceed by a one-step mechanism through asynchronous transition states. Ortho regioselectivity and anti diastereofacial selectivity are predicted in complete agreement with the experimental outcomes.
Bibliographic Details
http://www.scopus.com/inward/record.url?partnerID=HzOxMe3b&scp=85084256660&origin=inward; http://dx.doi.org/10.1007/s00894-020-04372-x; http://www.ncbi.nlm.nih.gov/pubmed/32382954; https://link.springer.com/10.1007/s00894-020-04372-x; https://dx.doi.org/10.1007/s00894-020-04372-x; https://link.springer.com/article/10.1007/s00894-020-04372-x
Springer Science and Business Media LLC
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