화학공학소재연구정보센터
검색결과 : 41건
No. Article
1 Reactivity of First-Row Transition Metal Monocations (Sc+, Ti+, V+, Zn+) with Methyl Fluoride: A Computational Study
Redondo P, Varela-Alvarez A, Rayon VM, Largo A, Sordo JA, Barrientos C
Journal of Physical Chemistry A, 117(14), 2932, 2013
2 Kinetics Studies of the Reactions of Main Fourth-Period Monocations (Ga+, Ge+, As+, and Se+) with Methyl Fluoride
Barrientos C, Rayon VM, Largo A, Sordo JA, Redondo P
Journal of Physical Chemistry A, 117(33), 7742, 2013
3 Canonical Variational Transition-State Theory Study of the CF3CHFCH2F + OH Reaction
Gonzalez-Lafont A, Lluch JM, Varela-Alvarez A, Sordo JA
Journal of Physical Chemistry A, 114(8), 2768, 2010
4 Desulfinylation of Prop-2-enesulfinic Acid: Experimental Results and Mechanistic Theoretical Analysis
Varela-Alvarez A, Markovic D, Vogel P, Sordo JA
Journal of the American Chemical Society, 131(27), 9547, 2009
5 Quantum calculations on the acid catalyzed rearrangements of norborn-5-en-2-one, 7-oxanorborn-5-en-2-one and 7-azanorborn-5-en-2-one - The electron-releasing effect of homoconjugated carbonyl group
Sordo JA, Varela-Alvarez A, Giani S, Vogel P
Applied Catalysis A: General, 336(1-2), 72, 2008
6 Canonical variational transition-state theory study of the CF3CH2CH3+OH reaction
Gonzalez-Lafont A, Lluch JM, Varela-Alvarez A, Sordo JA
Journal of Physical Chemistry B, 112(2), 328, 2008
7 A computational study on the reaction of N(D-2) atoms with CH2Cl radicals
Cimas A, Rayon VM, Barrientoas C, Aschi M, Sordo JA, Largo A
Chemical Physics Letters, 422(1-3), 276, 2006
8 Bis(allyl)-ruthenium(IV) complexes as highly efficient catalysts for the redox isomerization of allylic alcohols into carbonyl compounds in organic and aqueous media: Scope, limitations, and theoretical analysis of the mechanism
Cadiemo V, Garcia-Garrido SE, Gimeno J, Varela-Alvarez A, Sordo JA
Journal of the American Chemical Society, 128(4), 1360, 2006
9 Mechanism of the diphenyldisulfone-catalyzed isomerization of alkenes. Origin of the chemoselectivity: Experimental and quantum chemistry studies
Markovic D, Varela-Alvarez A, Sordo JA, Vogel P
Journal of the American Chemical Society, 128(24), 7782, 2006
10 A computational study of the reaction of ground-state nitrogen atoms with chloromethyl radicals
Cimas A, Rayon VM, Aschi M, Barrientos C, Sordo JA, Largo A
Journal of Physical Chemistry A, 109(29), 6540, 2005