Publicaciones ISI 2010 (DCQ)

PUBLICACIONES ISI DCQ 2010 (Diciembre-30-2010)

A la fecha nuestra Universidad cuenta con  144 registros  en el ISI Web of Science correspondientes  al año 2010. De estos, 41 artículos ( 28.5% ) se  encuentran asociados a nuestro Departamento de Ciencias Químicas.   El listado completo de dichas  publicaciones  sigue a continuación:

1.      D. Paez-Hernandez, R. Ramirez-Tagle, E. Codorniu-Hernandez, L. A. Montero-Cabrera and R. Arratia-Perez, Polyhedron, 29, 975-984, 2010. Quantum Relativistic Investigation About the Coordination and Bonding Effects of Different Ligands on Uranyl Complexes.

2.      R. S. Chauhan, G. Kedarnath, A. Wadawale, A. Munoz-Castro, R. Arratia-Perez, V. K. Jain and W. Kaim, Inorg. Chem., 49, 4179-4185, 2010. Tellurium(0) as a Ligand: Synthesis and Characterization of 2-Pyridyltellurolates of Platinum(Ii) and Structures of [Pt{2-Te-3-(R)C5h3n}(2)Te(Pr '(3))] (R = H or Me).

3.      D. M. L. Carey, C. Morales-Verdejo, A. Munoz-Castro, F. Burgos, D. Abril, C. Adams, E. Molins, O. Cador, I. Chavez, J. M. Manriquez, R. Arratia-Perez and J. Y. Saillard, Polyhedron, 29, 1137-1143, 2010 [Cp*Ru(S-Indacene)Rucp*] and [Cp*Ru(S-Indacene)Rucp*](+): Experimental and Theoretical Findings Concerning the Electronic Structure of Neutral and Mixed Valence Organometallic Systems.

4.      A. Munoz-Castro and R. Arratia-Perez, J. Phys. Chem. A, 114, 5217-5221, 2010. Electronic Delocalization, Energetics, and Optical Properties of Tripalladium Ditropylium Halides, [Pd-3(C7h7)(2)X-3](1-)(X = Cl-, Br-, and I-)

5.      A. Munoz-Castro, D. M. Carey and R. Arratia-Perez, J. Phys. Chem. A, 114, 666-672, 2010. Calculated Molecular Properties of Triangular Tribenzo and Perfluoro-Tribenzo Trimercuronin Macrocycles.

6.      A. Munoz-Castro, D. M. L. Carey and R. Arratia-Perez, J. Chem. Phys., 132, 6, 2010. Spin-Orbit Effects on Electronic Delocalization. Aromaticity in a Discrete Square Tetrapalladium Sandwich Complex.

7.      A. Munoz-Castro, D. M. L. Carey and R. Arratia-Perez, ChemPhysChem, 11, 646-650, 2010. Inside a Superatorn: TheM(7)(q) (M = Cu, Ag, q=1+, 0, 1-) Case.

8.      A. Munoz-Castro, D. M. L. Carey and R. Arratia-Perez, Polyhedron, 29, 451-455, 2010.  Relativistic Electronic Structure of Cadmium(Ii) Multidecker Phthalocyanine Compounds.

9.      A. Munoz-Castro, D. M. L. Carey, C. Morales-Verdejo, I. Chavez, J. M. Mariquez and R. Arratia-Perez, Inorg. Chem., 49, 4175-4178, 2010. Toward the Synthetic Control of the Homo-Lumo Gap in Binuclear Systems: Insights from Density Functional Calculations.

10.  N. Van, I. Tiritiris, R. F. Winter, B. Sarkar, P. Singh, C. Duboc, A. Munoz-Castro, R. Arratia-Perez, W. Kaim and T. Schleid, Chem.-Eur. J., 16, 11242-11245, 2010. Oxidative Perhydroxylation of [Closo-B12h12](2-) to the Stable Inorganic Cluster Redox System [B-12(Oh)(12)](2-/.-): Experiment and Theory.

11.  R. Veloso-Bahamonde, R. Ramirez-Tagle and R. Arratia-Perez, Chem. Phys. Lett., 491, 214-217, 2010.  DFT-Modeling of the Tungsten (V) Cofactor of Hyperthermophilic Pyrococcus Furiosus Tungsto-Bispterin Enzyme Via the Calculated Epr Parameters.

12.  R. Ramirez-Tagle, L. Alvarado-Soto, L. Hernandez-Acevedo and R. Arratia-Perez, J. Chil. Chem. Soc., 55, 39-43, 2010.  Dedicated to Dr. Pablo Dobud Urqueta.

13.  X. Zarate, E. Schott, D. M. L. Carey, C. Bustos and R. Arratia-Perez, Theochem-J. Mol. Struct., 957, 126-132, 2010. DFT Study on the Electronic Structure, Energetics and Spectral Properties of Several Bis(Organohydrazido(2-)) Molybdenum Complexes Containing Substituted Phosphines and Chloro Atoms as Ancillary Ligands.

14.  X. Y. Tu, E. Boroson, H. Truong, A. Munoz-Castro, R. Arratia-Perez, G. S. Nichol and Z. P. Zheng, Inorg. Chem., 49, 380-382, 2010. Cluster-Bound Nitriles Do Not Click with Organic Azides: Unexpected Formation of Imino Complexes of the [Re-6(Mu(3)-Se)(8)](2+) Core-Containing Clusters.

15.  N. Katir, P. Riviere, M. Riviere-Baudet, A. Castel, C. Adams, D. M. Carey, P. Aguirre-Etcheverry, I. Chavez, J. M. Manriquez, E. Diaz and M. Dahrouch, Inorg. Chim. Acta, 363, 3714-3720, 2010. From Polysubstituted 1,5-Dihydro-S-Indacene Lithium Derivatives to Polysubstituted Hydro-S-Indacenyl Radicals by a New Method Involving a Single Electron Transfer from an Electron Rich Olefin.

16.  A. Cuetos, M. L. Valenzuela, I. Lavandera, V. Gotor and G. A. Carriedo, Biomacromolecules, 11, 1291-1297, 2010. Polyphosphazenes as Tunable and Recyclable Supports to Immobilize Alcohol Dehydrogenases and Lipases: Synthesis, Catalytic Activity, and Recycling Efficiency.

17.  C. Diaz, M. L. Valenzuela, A. Laguna, V. Lavayen, J. Jimenez, L. A. Power and C. O’Dwyer, Langmuir, 26, 10223-10233, 2010. Metallophosphazene Precursor Routes to the Solid-State Deposition of Metallic and Dielectric Microstructures and Nanostructures on Si and Sio2.

18.  C. Diaz, M. L. Valenzuela, N. Yutronic and P. Aguirre, J. Chil. Chem. Soc., 55, 415-418, 2010. Gelation of N3p3[Nh(Ch2)(3)Si(Oet)(3)](6-N) [X](N) X = Nh(Ch2)(3)Si(Oet)(3), Nch3(Ch2)(3)Cn and Oc6h4(Ch2)Cn, N=0 or 3 at the Liquid/Air/Interface.

19.  L. R. Domingo, E. Chamorro and P. Perez, Org. Biomol. Chem., 8, 5495-5504, 2010. Understanding the Mechanism of Non-Polar Diels-Alder Reactions. A Comparative Elf Analysis of Concerted and Stepwise Diradical Mechanisms.

20.  L. R. Domingo, E. Chamorro and P. Perez, Lett. Org. Chem., 7, 432-439, 2010. Understanding the High Reactivity of the Azomethine Ylides in [3+2] Cycloaddition Reactions.

21.  F. De Vleeschouwer, P. Jaque, P. Geerlings, A. Toro-Labbe and F. De Proft, J. Org. Chem., 75, 4964-4974, 2010. Regioselectivity of Radical Additions to Substituted Alkenes: Insight from Conceptual Density Functional Theory.

22.  P. Jaque, JV Correa, F. De Proft F, A. Toro-Labbe, P. Geerlings, Can J. Chem. 88, 858-865, 2010. Regaining the Woodward-Hoffmann rules for chelotropic reactions via conceptual DFT.

23.  P. Fuentealba, E. Florez and W. Tiznado, J. Chem. Theory Comput., 6, 1470-1478, 2010. Topological Analysis of the Fukui Function.

24.  Salamanca, W. Tiznado and P. Jaramillo, Vitae, 17, 199-208, 2010. Experimental and Theoretical Study of Shyntesis of N-Alkyl-Nitroimidazoles.

25.  AC Castro, E. Osorio, JOC Jimenez-Halla,  E. Matito,  W. Tiznado, G. Merino, J. Chem. Theory Comput., 6, 2701-2705, 2010. Scalar and Spin-Orbit Relativistic Corrections to the NICS and the Induced Magnetic Field: The case of the E-12(2-) Spherenes (E = Ge, Sn, Pb)

26.  P. Perez and E. Chamorro, J. Mol. Struct. Theochem, 943, 110-114, 2010. Global and Local Reactivity of N-Heterocyclic Carbenes with Boron and Phosphorus Atoms: An Analysis Based on Spin Polarized Density Functional Framework.

27.  J. D. Ripoll, A. Serna, D. Guerra and A. Restrepo, J. Phys. Chem. A, 114, 10917-10921, 2010. Electronic Structure Calculations on Helical Conducting Polymers.

28.  J. C. Santos, M. Contreras and G. Merino, Chem. Phys. Lett., 496, 172-174, 2010 Structure and Stability of Si6li6: Aromaticity vs. Polarizability.

29.  Sierra, A. H. Klahn, R. Ramirez-Tagle, R. Arratia-Perez, F. Godoy, M. T. Garland and M. Fuentealba, Dalton Trans., 39, 6295-6301, 2010. Heterobimetallic Re=Pd Complexes Bridged by Eta(1):Eta(5)-Ph2pc5h4 Ligand. Synthesis, Electronic and Crystal Structure of (Co)(2)(Pr3)(Eta(5)-C5h4(Pph2)Re-P)over Bardcl(2), R = Me and Ome.

30.  A. Trujillo, M. Fuentealba, D. Carrillo, C. Manzur, I. Ledoux-Rak, J. R. Hamon and J. Y. Saillard, Inorg. Chem., 49, 2750-2764, 2010. Synthesis, Spectral, Structural, Second-Order Nonlinear Optical Properties and Theoretical Studies on New Organometallic Donor-Acceptor Substituted Nickel(Ii) and Copper(Ii) Unsymmetrical Schiff-Base Complexes.

31.  R. Ugarte, G. Salgado, R. Martinez and J. Navarrete, Quim. Nova, 33, 750-754,  2010. Theoretical Study of the Isomerization of Maleic Acid into Fumaric Acid: An Approach Based on the Concept of Potential Energy Surface.

32.  Valdebenito, M. T. Garland, M. Fuentealba and C. A. Escobar, Acta Crystallogr. Sect. E.-Struct Rep. Online, 66, M838-U1122, 2010. (E)-3-Ferrocenyl-1-(2-Hydroxyphenyl)-Prop-2-En-1-One.

33.  Venegas-Yazigi, K. Munoz-Becerra, E. Spodine, K. Brown, C. Aliaga, V. Paredes-Garcia, P. Aguirre, A. Vega, R. Cardoso-Gil, W. Schnelle and R. Kniep, Polyhedron, 29, 2426-2434, 2010. Magnetic and Catalytic Properties of the 2d Copper(Ii) Functionalized Vpo Hybrid System [{Cu(Bpy)}(2)(Vo)(3)(Po4)(2)(Hpo4)(2)]Center Dot 2h(2)O.

34.  L. E. Catalan, E. B. Maturana, K. C. Marin, M. O. Olivares, H. Carrasco Altamirano, M. C. Fritis and J. V. Garcia, Molecules, 15, 6502-6511, 2010 Synthesis and Antitumor Activity of Diterpenylhydroquinone Derivatives of Natural Ent-Labdanes.

35.  J. Murillo, J. David and A. Restrepo, Phys. Chem. Chem. Phys., 12, 10963-10970, 2010. Insights into the Structure and Stability of the Carbonic Acid Dimer.

36.  F. Ferraro and C. Z. Hadad, J. Phys. Chem. A, 114, 5068-5075, 2010. A Microscopic-Macroscopic Analysis for Mixed Energy Transfer Schemes in Doped Amorphous Solids.

37.  E. Florez, T. Gomez, P. Liu, J. A. Rodriguez and F. Illas, ChemCatChem, 2, 1219-1222, 2010. Hydrogenation Reactions on Au/Tic(001): Effects of Au-C Interactions on the Dissociation of H-2.

38.  T. Gomez, E. Florez, J. A. Rodriguez and F. Illas, J. Phys. Chem. C, 114, 1622-1626, 2010. Theoretical Analysis of the Adsorption of Late Transition-Metal Atoms on the (001) Surface of Early Transition-Metal Carbides.

39.  N. Inostroza and M. L. Senent, J. Chem. Phys., 133, 9, 2010. Theoretical Characterization of the SiC3H- Anion.

40.  G. Mino and R. Contreras, Chem. Phys. Lett., 486, 119-122, 2010. Non-Electrostatic Components of Short and Strong Hydrogen Bonds Induced by Compression inside Fullerenes.

41.  S. Guerrero, E. Araya, J. L. Fiedler, J. I. Arias, C. Adura, F. Albericio, E. Giralt, J. L. Arias, M. S. Fernandez and M. J. Kogan, Nanomedicine, 5, 897-913, 2010. Improving the Brain Delivery of Gold Nanoparticles by Conjugation with an Amphipathic Peptide.


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