Category: Uncategorized

DOI:10.1039/C5NJ00600G

C.Trujillo, G. Sánchez-Sanz, I. Alkorta, J. Elguero

Halogen, Chalcogen and Pnictogen Interactions in (XNO2)2 Homodimers (X = F, Cl, Br, I)

 

DOI:10.1002/cphc.201500317

C. Trujillo, G. Sánchez-Sanz, I. Alkorta, J. Elguero

Computational study of proton transfer in 3(5)-hydroxypyrazole tautomers assisted by water

DOI:10.3390/molecules20059214

C. Trujillo, A. A. Rodríguez-Sanz, I. Rozas

Aromatic Aminoacids-Guanidinium Complexes through Cationn- π Interactions

DOI:10.1039/C5CP00876J

G. Sánchez-Sanz, C. Trujillo, I. Rozas, I. Alkorta

Influence of fluoro and cyano substituents in the aromatic and antiaromatic characteristics of cyclooctatetraene

DOI:10.1016/j.comptc.2014.07.009

G. Sanchez-Sanz, C. Trujillo, I. Alkorta, J. Elguero

Theoretical study of cyanophosphines:Pnicogen vs. dipole-dipole interactions

DOI:10.1016/j.comptc.2014.11.018

C. Trujillo and J. A. Gámez

Kinetical and Thermodynamical Analysis of the Reactivity of Thiourea by Association to Ca²⁺

DOI:10.1002/cphc.201402442

C. Trujillo, G. Sánchez-Sanz, I. Alkorta, J. Elguero

A computational study of 3-azonia-, 3-phosphonia- and 3-arsonia- spiro[2.2]pentanes and related three-membered heterocycles

DOI:10.1002/chem.201402551

C. Trujillo, G. Sánchez-Sanz, I. Karpaviciene, U. Jahn, I. Cikotiene, L. Rulisek

Divergent Pathways and Competitive Mechanisms of Metathesis Reactions Between 3-Arylprop-2-inyl esters and Aldehydes:  An Experimental and Theoretical Study

DOI:10.1039/C4CP01072H

G. Sánchez-Sanz, C. Trujillo, I. Alkorta, J. Elguero

Intramolecular pnicogen interactions in phosphorus and arsenic analogues of proton sponges

DOI: 10.1016/j.molstruc.2013.04.069

C. Trujillo, G. Sánchez-Sanz, I. Alkorta, J. Elguero, O. Mó, M. Yáñez

Resonance assisted hydrogen bonds in open-chain and cyclic structures of malonaldehyde enol: A theoretical study