A theoretical study of neutral and reduced tetracyano-p-quinodimethane (TCNQ).
B. Milián, R. Pou-Amérigo, R. Viruela, E. Ortí.
J. Mol. Struct. (Theochem), 2004 709, 97-102.

A new series of pi-extended tetrathiafulvalene derivatives incorporating fused furanodithiino and thienodithiino units: a joint experimental and theoretical study.
R. Berridge, I.M. Serebryakov, P.J. Skabara, E. Ortí, R. Viruela, R. Pou-Amérigo, S.J. Coles, M.B. Hursthouse.
J. Mater. Chem.2004 14, 2822-2830.

On the electron affinity of TCNQ.
B. Milián, R. Pou-Amérigo, R. Viruela, E. Ortí.
Chem. Phys. Lett., 2004391, 148-151.

Highly conjugated p-quinonoid pi-extended tetrathiafulvalene derivatives: A class of highly distorted electron donors.
M.C. Díaz, B.M. Illescas, N. Martín, R. Viruela, P.M. Viruela, E. Ortí, O. Brede, I. Zilbermann, D.M. Guldi.
Chem. Eur. J.200410, 2067-2077.

Spectroscopic and theoretical study of the molecular and electronic structures of a terthiophene-based quinodimethane.
J. Casado, T.M. Pappenfus, K.R. Mann, E. Ortí, P.M. Viruela, B. Milián, V. Hernández, J.T. López Navarrete.
ChemPhysChem20045, 529-539.

The low-lying excited states of 2,2'-bithiophene: A theoretical analysis.
M. Rubio, M. Merchán, R. Pou-Amérigo, E. Ortí.
ChemPhysChem20034, 1308-1315.

Spectroscopic and theoretical study of push-pull chromophores containing thiophene-based quinonoid structures as electron spacers.
B. Milián, E. Ortí, V. Hernández, J.T. López Navarrete, T. Otsubo.
J. Phys. Chem. B2003107, 12175-12183.

First signals of electrochemically oxidized species of TTF and TTM-TTF: A study by in situ spectroelectrochemical FTIR and DFT calculations.
C. Wartelle, R. Viruela, P.M. Viruela, F.X. Sauvage, M. Sallé, E. Ortí, E. Levillain, F. Le Derf.
Phys. Chem. Chem. Phys., 20035, 4672-4679.

UV-Vis, IR, Raman and theoretical characterization of a novel quinoid oligothiophene molecular material.
J. Casado, T.M. Pappenfus, K.R. Mann, B. Milián, E. Ortí, P.M. Viruela, M.C. Ruiz Delgado, V. Hernández, J.T. López Navarrete.
J. Mol. Struct. 2003651-653, 665-673.

Theoretical study of the molecular structure and the stability of neutral and reduced tetracyanoethylene.
B. Milián, R. Pou-Amérigo, R. Viruela, E. Ortí.
Chem. Phys. Lett.2003375, 376-382.

Theoretical description of the Raman spectrum of a vinylene-bridged quaterthiophene oligomer.
P.M. Viruela, R. Viruela, E. Ortí, J. Casado, V. Hernández, J.T. López-Navarrete.
J. Mol. Struct., 2003651-653, 657-664.

Nitro-functionalized oligothiophenes as a novel type of electroactive molecular material: Spectroscopic, electrochemical, and computational study.
J. Casado, T.M. Pappenfus, L.L. Miller, K.R. Mann, E. Ortí, P.M. Viruela, R. Pou-Amérigo, V. Hernández, J.T. López Navarrete.
J. Am. Chem. Soc.2003125, 2524-2534.

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Head of the Group.

Prof. Enrique Ortí

E-mail: enrique.orti@uv.es
Phone nr: +34 963544438

 

 

Postal Address:

Instituto de Ciencia Molecular (ICMol)

Universidad de Valencia
Catedrático José Beltrán nº 2
46980 Paterna
Spain

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