Saeedreza Emamian
Saeedreza Emamian
Islamic Azad University (ORCID:0000-0001-8223-1264)
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Exploring nature and predicting strength of hydrogen bonds: a correlation analysis between atoms-in-molecules descriptors, binding energies, and energy components of symmetry …
S Emamian, T Lu, H Kruse, H Emamian
Journal of Computational Chemistry (JCC), 2019
Understanding the mechanisms of [3+ 2] cycloaddition reactions. The pseudoradical versus the zwitterionic mechanism
LR Domingo, SR Emamian
Tetrahedron 70 (6), 1267-1273, 2014
Theoretical study of intramolecular hydrogen bonding in the halo derivatives of 1-amino-3-imino-prop-1-ene
S Emamian, SF Tayyari
Journal of Chemical Sciences 125 (4), 939-948, 2013
Tautomerism in pyridazin-3 (2H)-one: a theoretical study using implicit/explicit solvation models
SR Emamian, LR Domingo, SF Tayyari
Journal of Molecular Graphics and Modelling 49, 47-54, 2014
Understanding the regioselectivity and molecular mechanism in the synthesis of isoxazoles containing pentafluorosulfanyl substitution via a [3+2] cycloaddition reaction: A DFT …
SR Emamian
Journal of Fluorine Chemistry, 2015
Understanding the stereoselectivity in Brønsted acid catalysed Povarov reactions generating cis/trans CF3-substituted tetrahydroquinolines: a DFT study
LR Domingo, M Ríos-Gutiérrez, S Emamian
RSC Advances 6, 17064-17073, 2016
Understanding the molecular mechanism in a regiospecific [3+2] cycloaddition reaction including C-O and C-S interactions : An ELF topological analysis
SR Emamian
RSC Advances 5, 72959–72970, 2015
Understanding the domino reactions between 1- diazopropan-2-one and 1,1-dinitroethylene. A molecular electron density theory study of the [3+2] cycloaddition reactions of …
LR Domingo, M Ríos-Gutiérrez, S Emamian
RSC Advances 7, 15586–15595, 2017
How the mechanism of a [3 + 2] cycloaddition reaction involving a stabilized N-lithiated azomethine ylide toward a p-deficient alkene is changed to stepwise by solvent polarity …
S Emamian
RSC Advances 6, 75299–75314, 2016
Understanding the Domino Reaction between 3-Chloroindoles and Methyl Coumalate yielding Carbazoles. A DFT Study
LR Domingo, JA Sáez, SR Emamian
Organic & Biomolecular Chemistry 13, 2034-2043, 2015
Copper (I)-Catalyzed Asymmetric Aza Diels-Alder Reaction of Azoalkenes Toward Fulvenes: A Molecular Electron Density Theory Study
S Emamian, M Soleymani, SS Moosavi
New Journal of Chemistry 43, 4765 - 4776, 2019
Understanding the molecular mechanism of the [3+2] cycloaddition reaction of benzonitrile oxide toward electron-rich N-vinylpyrrole: A DFT Study.
LR Domingo, S Emamian, M Salami, M Ríos-Gutiérrez
Journal of Physical Organic Chemistry 29, 368–376, 2016
Can the high reactivity of azomethine betaines in [3+2] cycloaddition reactions be explained using singlet-diradical character descriptors? What molecular mechanism is actually …
SR Emamian, T Lu, F Moeinpour
RSC Advances 5, 62248–62259, 2015
Conformational analysis, structure, and normal coordinate analysis of vibrational spectra of hexafluoroacetone. A density functional theory study
SF Tayyari, M Gholamhoseinpour, S Emamian, RE Sammelson
Journal of Fluorine Chemistry 184, 65-71, 2016
Polar Diels-Alder reaction of isoprene toward 2-bromocyclobutenone followed by a subsequent sodium hydroxide-assisted ring contraction reaction. A regio- and stereoselectivity …
SR Emamian
New Journal of Chemistry 39, 9525-9534, 2015
Mechanism and regioselectivity of 1, 3-dipolar cycloaddition reactions of sulphur-centred dipoles with furan-2, 3-dione: A theoretical study using DFT
Journal of Chemical Sciences 126 (1), 293-302, 2014
Toward understanding regioselectivity and molecular mechanism in the synthesis of CF2H-containing 2-pyrazolines: a molecular electron-density theory study
S Emamian
Journal of Fluorine Chemistry 199, 77-91, 2017
A Molecular Electron Density Theory study of the chemo- and regioselective [3+2] cycloaddition reactions between trifluoroacetonitrile N-oxide and thioketones
S Emamiana, T Lu, LR Domingo, LH Saremi, M Ríos-Gutiérrezc
Chemical Physics 501, 128-137, 2018
A Molecular Electron Density Theory Study of [3+2] Cycloaddition Reaction between Azomethine Ylides and Electron-Deficient Nitroalkenes
S Emamian
ChemistrySelect 2, 4193 – 4203, 2017
Structure and vibrational assignment of the enol form of 1-chloro-1, 1-difluoro-pentane-2, 4-dione
SF Tayyari, A Najafi, R Afzali, S Emamian, YA Wang
Journal of Molecular Structure 878 (1-3), 10-21, 2008
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