Concepedia

A DFT computational study on the molecular mechanism of the nitro group migration in the product derived from 3-nitro-2-(trifluoromethyl)-2 H -chromene and 2-(1-phenylpropylidene)malononitrile

Agnieszka Łapczuk-Krygier, Vladislav Yu. Korotaev, Alexey Yu. Barkov, Vyacheslav Ya. Sosnovskikh, Ewa Jasińska, Radomir Jasiński

Journal of Fluorine Chemistry · 2014 · 16 citations · 16 references

DOI

Concepts

References

16

Energies, structures, and electronic properties of molecules in solution with the C‐PCM solvation model

Maurizio Cossi, Nadia Rega, Giovanni Scalmani et al. · Journal of Computational Chemistry · 2003 · 7.9K citations

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Synthesis and Antitumor Activity of Quinonoid Derivatives of Cannabinoids

Natalya M. Kogan, Ruth Rabinowitz, Paloma Levi et al. · Journal of Medicinal Chemistry · 2004 · 106 citations

, , +11

Empirical Equation for Calculating the Density of Oxide Glasses

Seiji Inaba, Shigeru Fujino · Journal of the American Ceramic Society · 2009 · 96 citations

, , +12

Searching for zwitterionic intermediates in Hetero Diels–Alder reactions between methyl α,p-dinitrocinnamate and vinyl-alkyl ethers

Radomir Jasiński · Computational and Theoretical Chemistry · 2014 · 76 citations

, , +11

Competition between the one-step and two-step, zwitterionic mechanisms in the [2+3] cycloaddition of gem-dinitroethene with (Z)-C,N-diphenylnitrone: a DFT computational study

Radomir Jasiński · Tetrahedron · 2012 · 60 citations

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