Papers in Journals

#Paper TitleAuthorsJournalPublished At
 
121Quantum chemical studies on molecular conformations, energetic and intramolecular hydrogen bonding in ground and electronic excited state of (thioxosilyl) ethyleneselenolHossein FarsiJournal of Sulfur Chemistry2014
122Ab initio and DFT studies on 1-(thionitrosomethylene) hydrazine conformers energies and intramolecular hydrogen-bond strengthKhanmohammadi Azadeh,yoosefian mehdiStructural Chemistry2013
123CONFORMATIONAL PROPERTIES AND INTRAMOLECULAR HYDROGEN BONDING OF 3-AMINO-PROPENESELENAL AN AB INITIO AND DENSITY FUNCTIONAL THEORY STUDIES_Journal of Theoretical and Computational Chemistry2013
124THEORETICAL INVESTIGATION OF SUBSTITUTION EFFECT IN 3-MERCAPTO-PROPENETHIALHossein FarsiJournal of Theoretical and Computational Chemistry2013
125Molecular structure vibrational assignments conformational stability ground and excited state hydrogen-bonding analysis of 2-Nitroso vinyl amine_Journal of Theoretical and Computational Chemistry2013
126Quantum chemical studies on molecular conformations energetic and intramolecular hydrogen bonding in ground and electronic excited state of (thioxosilyl) ethyleneselenolHossein FarsiJournal of Sulfur Chemistry2013
127Substituent effect on the reaction mechanism of proton transfer in formamide_International Journal of Quantum Chemistry2012
128A comparative study of open-close and related rotamers methods to evaluate the intramolecular hydrogen bond energies in 3-imino-propen-1-ol and its derivativesHajiabadi H, Nowroozi A.R,Hasani M,Mohammadzadeh Jahani PInternational Journal of Quantum Chemistry2012
129The effect of substitution on structure intramolecular hydrogen bonding strength electron density and resonance in 3-amino 2-iminomethyl acryl aldehyde_Journal of Theoretical and Computational Chemistry2012
130Hydrogen bond studies in substituted imino-acetaldehyde oxime_Computational and Theoretical Chemistry2012
131Comprehensive study of the interaction between hydrogen halides and methanol derivatives_International Journal of Quantum Chemistry2012
132Theoretical study on -aminoacroleine Density functional theory atoms in molecules theory and natural bond orbitals studies_Journal of Chemical Sciences2012
133Synthesis and theoretical study of intramolecular hydrogen bond at two possible positions in pyrazolo 1 2-b phthalazine_Chinese Journal of Chemistry2012
134Conformational study of the (z)- (2-iminoethylidone)silyl amine at the MP2 DFT and G2MP2 levels_Computational and Theoretical Chemistry2012
135Conformational study molecular structure and S..HN S..HN intramolecular hydrogen bond in thioformyl-3-aminoacrylaldehyde_Journal of Sulfur Chemistry2012
136Evaluation of the origin of conformational and tautomeric preferences in N-formylformamide - A quantum chemical studyNowroozi A.International Journal of Quantum Chemistry2012
137Solvent Free synthesis and crystal structure of s-cis and s-trans N N-bis (2-hydroxy cyclohexyl ethane-1 2-diamine)Hakimi Mohammad,Kukovec Boris-Marko,Pouyanmehr Leila,Mohr Fabian,Esther SchuhStructural Chemistry2012
138Theoretical Description of Substituent E ects in 2 4-Pentanedione AIM NBO and NMR Studyshakhs Imampour Jalal,Karimi MohammadBulletin of the Chemical Society of Japan2012
139Theoretical study on - aminoacrolein Density functional theory atoma in molecules theory and natural bond orbitals studies,Journal of Chemical Sciences2012
140A comparative study in 3-imino-propen-1-ol and its derivatives,,,International Journal of Quantum Chemistry2012
Showing 121-140 of 154 items.