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Diels‐Alder Reaction of Oxazolidine‐fused Butadienes Toward Alkenes: Shedding Light on the Energetics, Selectivities, and Molecular Mechanistic Aspects by a Density Functional Theory Study.
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- ChemistrySelect, 2023, v. 8, n. 25, p. 1, doi. 10.1002/slct.202300710
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- Article
A comprehensive theoretical analysis on the intermolecular hydrogen bond interactions with the Lewis bases having multiple hydrogen bonding abilities.
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- Journal of Physical Organic Chemistry, 2022, v. 35, n. 9, p. 1, doi. 10.1002/poc.4357
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- Article
Exploring influence of fluorine substitution on the strength and nature of halogen bond between iodobenzene and hydrogen cyanide.
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- Journal of Physical Organic Chemistry, 2021, v. 34, n. 8, p. 1, doi. 10.1002/poc.4213
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- Article
Hexamethylphosphanetriamine‐mediated aziridination of imines with alpha‐ketoesters: A molecular electron density theory study.
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- Journal of Physical Organic Chemistry, 2020, v. 33, n. 7, p. 1, doi. 10.1002/poc.4058
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- Article
A Study of the Effects of the Lewis Acid Catalysts on Oxa‐Diels‐Alder Reactions through Molecular Electron Density Theory.
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- ChemistrySelect, 2020, v. 5, n. 17, p. 5341, doi. 10.1002/slct.202001061
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- Article
Shedding light on the energetics, regioselectivity, stereoselectivity, and mechanistic aspects of [3 + 2] cycloaddition reaction between azomethine imines and 2‐sulfolene through molecular electron density theory.
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- Journal of Physical Organic Chemistry, 2020, v. 33, n. 4, p. 1, doi. 10.1002/poc.4042
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- Article
Exploring Nature and Predicting Strength of Hydrogen Bonds: A Correlation Analysis Between Atoms‐in‐Molecules Descriptors, Binding Energies, and Energy Components of Symmetry‐Adapted Perturbation Theory.
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- Journal of Computational Chemistry, 2019, v. 40, n. 32, p. 2868, doi. 10.1002/jcc.26068
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- Article
Stereoselective cyclopropanation of olefins through ammonium ylides: A molecular electron density theory study.
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- Journal of Physical Organic Chemistry, 2019, v. 32, n. 12, p. N.PAG, doi. 10.1002/poc.4008
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[3 + 2] cycloaddition reaction of N,N′ cyclic azomethine imines toward highly electron‐deficient nitroalkenes: A molecular electron density theory study.
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- Journal of Physical Organic Chemistry, 2019, v. 32, n. 5, p. N.PAG, doi. 10.1002/poc.3925
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- Article
Aziridination of Aromatic Aldimines Through Stabilized Ammonium Ylides: A Molecular Electron Density Theory Study.
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- European Journal of Organic Chemistry, 2019, v. 2019, n. 7, p. 1605, doi. 10.1002/ejoc.201801763
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- Article
Conformational stability, barriers to internal rotations, and normal coordinate analysis of acetone and its <sup>2</sup>H-isotopomers.
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- Canadian Journal of Chemistry, 2016, v. 94, n. 10, p. 818, doi. 10.1139/cjc-2016-0163
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Understanding the molecular mechanism of the.
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- Journal of Physical Organic Chemistry, 2016, v. 29, n. 7, p. 368, doi. 10.1002/poc.3544
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- Article
Theoretical study of intramolecular hydrogen bonding in the halo derivatives of 1-amino-3-imino-prop-1-ene.
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- Journal of Chemical Sciences, 2013, v. 125, n. 4, p. 939, doi. 10.1007/s12039-013-0466-y
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- Article