E. Cabaleiro-Lago: search on Z-Library

The world's largest scientific articles store. 70,000,000+ articles for free.

Don't use scam websites

1

A DFT Study of the Boulton−Katritzky Rearrangement of (5 R )-4-Nitrosobenz[ c ]isoxazole and Its Anion: Pseudopericyclic Reactions with Aromatic Transition States

Peña-Gallego, Angeles, Rodríguez-Otero, Jesús, Cabaleiro-Lago, Enrique M.

Journal:

Journal of Organic Chemistry

Year:

2004

Language:

english

File:

PDF, 354 KB

english, 2004

2

A Density Functional Theory Study on the Electrocyclization of 1,2,4,6-Heptatetraene Analogues: Converting a Pericyclic to a Pseudopericyclic Reaction

Enrique M. Cabaleiro-Lago, Jesús Rodríguez-Otero, Rosa M. García-López, Angeles Peña-Gallego, Jose M. Hermida-Ramón

Journal:

Chemistry - A European Journal

Year:

2005

Language:

english

File:

PDF, 340 KB

english, 2005

3

Computational study of the dissociation of oxalic acid in water clusters

Jose M Hermida-Ramón, Enrique M Cabaleiro-Lago, Jesús Rodrı́guez-Otero

Journal:

Chemical Physics

Year:

2004

Language:

english

File:

PDF, 381 KB

english, 2004

4

A DFT study of the [4+2] cycloadditions of conjugated ketenes (vinylketene, imidoylketene and formylketene) with formaldimine. The pericyclic or pseudopericyclic character from magnetic properties

Angeles Peña-Gallego, Jesús Rodríguez-Otero, Enrique M. Cabaleiro-Lago

Journal:

Year:

2007

Language:

english

File:

PDF, 766 KB

english, 2007

5

The study of A(CH3OH)1–6 (A = Li+, Na+) in the gas phase based on ab initio calculations, analysis of the solvation process

Alba Garcı́a-Muruais, Enrique M. Cabaleiro-Lago, Jose M. Hermida-Ramón, Miguel A. Rı́os

Journal:

Chemical Physics

Year:

2000

Language:

english

File:

PDF, 286 KB

english, 2000

6

DFT conformational study of cysteine in gas phase and aqueous solution

A. Fernández-Ramos, E. Cabaleiro-Lago, J.M. Hermida-Ramón, E. Martı́nez-Núñez, A. Peña-Gallego

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2000

Language:

english

File:

PDF, 419 KB

english, 2000

7

Density Functional Theory Study of Ruthenium (II)-Catalyzed [2+2+2] Cycloaddition of 1,6-Diynes with Tricarbonyl Compounds

Rodríguez-Otero, Jesús, Montero-Campillo, M. Merced, Cabaleiro-Lago, Enrique M.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 398 KB

english, 2008

8

Evaluation of Magnetic Properties as a Criterion for the Elucidation of the Pseudopericyclic Character of 1,5-Electrocyclizations in Nitrile Ylides

Cabaleiro-Lago, Enrique M., Rodríguez-Otero, Jesús, Hermida-Ramón, Jose M.

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 98 KB

english, 2003

9

A Comparative Theoretical Study of the Pericyclic-pseudopericyclic Character in a Group of Cyclizations of Dienylketenes to Cyclohexadienones

Peña-Gallego, A., Rodríguez-Otero, J., Cabaleiro-Lago, E. M.

Journal:

Journal of Physical Chemistry A

Year:

2007

Language:

english

File:

PDF, 457 KB

english, 2007

10

Inactivation and Adsorption of Human Carbonic Anhydrase II by Nanoparticles

Assarsson, Anna, Pastoriza-Santos, Isabel, Cabaleiro-Lago, Celia

Journal:

Year:

2014

Language:

english

File:

PDF, 1.65 MB

english, 2014

11

Charge Dependent Retardation of Amyloid β Aggregation by Hydrophilic Proteins

Assarsson, Anna, Hellstrand, Erik, Cabaleiro-Lago, Celia, Linse, Sara

Journal:

ACS Chemical Neuroscience

Year:

2014

Language:

english

File:

PDF, 2.24 MB

english, 2014

12

Electrocyclization of (Z)-1,2,4,6-Heptatetraene and its Heterosubstituted Analogues: Pericyclic or Pseudopericyclic?

Jesús Rodríguez -Otero, Enrique M. Cabaleiro-Lago

Journal:

Angewandte Chemie

Year:

2002

Language:

english

File:

PDF, 96 KB

english, 2002

13

Electrocyclization of (Z)-1,2,4,6-Heptatetraene and its Heterosubstituted Analogues: Pericyclic or Pseudopericyclic?

Jesús Rodríguez -Otero, Enrique M. Cabaleiro-Lago

Journal:

Angewandte Chemie International Edition

Year:

2002

Language:

english

File:

PDF, 156 KB

english, 2002

14

Criteria for the Elucidation of the Pseudopericyclic Character of the Cyclization of (Z)-1,2,4,6-Heptatetraene and Its Heterosubstituted Analogues: Magnetic Properties and Natural Bond Orbital Analysis

Jesús Rodríguez-Otero, Enrique M. Cabaleiro-Lago

Journal:

Chemistry - A European Journal

Year:

2003

Language:

english

File:

PDF, 163 KB

english, 2003

15

A DFT Study of the Interaction between Microhydrated Anions and Naphthalendiimides

Alba Campo-Cacharrón, Prof. Enrique M. Cabaleiro-Lago, Prof. Jesús Rodríguez-Otero

Journal:

Year:

2012

Language:

english

File:

PDF, 689 KB

english, 2012

16

A DFT Study of the Concerted Cyclisation of 3-Azidopropenal to Isoxazole:Is it a Pseudopericyclic Reaction According to Its Magnetic Properties?

Angeles Peña-Gallego, Jesús Rodríguez-Otero, Enrique M. Cabaleiro-Lago

Journal:

European Journal of Organic Chemistry

Year:

2005

Language:

english

File:

PDF, 109 KB

english, 2005

17

DFT Study of the Nucleophilic Addition of Water to Ketenes

Jesús Rodríguez-Otero, Jose M. Hermida-Ramón, Enrique M. Cabaleiro-Lago

Journal:

European Journal of Organic Chemistry

Year:

2007

Language:

english

File:

PDF, 186 KB

english, 2007

18

Spectrophotometric study of metal–ligand reactions in isooctane/Brij30/water nonionic microemulsions

C. Cabaleiro-Lago, L. Garcia-Río, P. Hervés, J. Pérez-Juste

Journal:

Colloids and Surfaces A: Physicochemical and Engineering Aspects

Year:

2007

Language:

english

File:

PDF, 181 KB

english, 2007

19

Nonionic microemulsions: Effects of the interface on metal–ligand reactions

C. Cabaleiro-Lago, L. García-Río, P. Hervés, J. Pérez-Juste

Journal:

Colloids and Surfaces A: Physicochemical and Engineering Aspects

Year:

2007

Language:

english

File:

PDF, 364 KB

english, 2007

20

Cation-π and anion-π interactions: Changes in aromaticity upon complexation

Jesús Rodríguez-Otero, Enrique M. Cabaleiro-Lago, Angeles Peña-Gallego

Journal:

Chemical Physics Letters

Year:

2008

Language:

english

File:

PDF, 144 KB

english, 2008

21

NMR diffusometry and conductometry study of the host–guest association between β-cyclodextrin and dodecane 1,12-bis(trimethylammonium bromide)

Celia Cabaleiro-Lago, Markus Nilsson, Artur J.M. Valente, Massimo Bonini, Olle Söderman

Journal:

Journal of Colloid and Interface Science

Year:

2006

Language:

english

File:

PDF, 140 KB

english, 2006

22

Theoretical study of the walk rearrangement in perfluorotetramethyl (Dewar thiophene) exo-S-oxide

Jesús Rodríguez-Otero, Enrique M. Cabaleiro-Lago, Ángeles Peña-Gallego

Journal:

Year:

2007

Language:

english

File:

PDF, 1.32 MB

english, 2007

23

A theoretical study of the influence of BF3 on the reaction path of the [4+2] cycloaddition of vinylketene with formaldimine

Angeles Peña-Gallego, Jesús Rodríguez-Otero, Enrique M. Cabaleiro-Lago

Journal:

Year:

2007

Language:

english

File:

PDF, 467 KB

english, 2007

24

On the mechanism of rhodium-catalyzed [6+2] cycloaddition of 2-vinylcyclobutanones and alkenes

M. Merced Montero-Campillo, Jesús Rodríguez-Otero, Enrique M. Cabaleiro-Lago

Journal:

Year:

2008

Language:

english

File:

PDF, 681 KB

english, 2008

25

Study of the ferrocene–lithium cation interaction by DFT calculations: an in-depth analysis of the existence of a planetary system

Jesús Rodríguez-Otero, Enrique M. Cabaleiro-Lago, Ángeles Peña-Gallego, M. Merced Montero-Campillo

Journal:

Year:

2009

Language:

english

File:

PDF, 331 KB

english, 2009

26

A computational study of the electrocyclization of o-divinylbenzene and derivatives

Enrique M. Cabaleiro-Lago, Jesús Rodríguez-Otero, Angeles Peña-Gallego

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2007

Language:

english

File:

PDF, 1.58 MB

english, 2007

27

A cooperative mechanism as the main source of the marked structural differences between solid and gaseous HCN⋯BF3

Enrique M. Cabaleiro-Lago, Miguel A. Rı́os

Journal:

Chemical Physics Letters

Year:

1998

Language:

english

File:

PDF, 78 KB

english, 1998

28

An ab initio study of the potential energy surface of methylamine dimer

Enrique M Cabaleiro-Lago, Jesús Rodrı́guez-Otero

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2002

Language:

english

File:

PDF, 131 KB

english, 2002

29

Ab initio study of M(CH3CN)n clusters (M=Li+, Na+, Mg2+) in the gas phase

Enrique M Cabaleiro-Lago, Miguel A Rı́os

Journal:

Chemical Physics

Year:

2000

Language:

english

File:

PDF, 228 KB

english, 2000

30

An intermolecular potential function for Na+–acetonitrile obtained from ab initio calculations.: Application to liquid simulations

Enrique M. Cabaleiro-Lago, Miguel A. Rı́os

Journal:

Chemical Physics

Year:

1998

Language:

english

File:

PDF, 167 KB

english, 1998

31

Study of the interaction between aniline and CH3CN, CH3Cl and CH3F

Enrique M. Cabaleiro-Lago, Jesús Rodríguez-Otero, Ángeles Peña-Gallego

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

2011

Language:

english

File:

PDF, 566 KB

english, 2011

32

Ab initio and DFT study of the aromaticity of some Fulvalenes derived from Methylidenecyclopropabenzene

M. Merced Montero-Campillo, Jesús Rodríguez-Otero, E. M. Cabaleiro-Lago

Journal:

Journal of Molecular Modeling

Year:

2007

Language:

english

File:

PDF, 464 KB

english, 2007

33

A computational study of the mechanism of the unimolecular elimination ofα,β-unsaturated aldehydes in the gas phase

Valentina Erastova, Jesús Rodríguez-Otero, Enrique M. Cabaleiro-Lago, Ángeles Peña-Gallego

Journal:

Journal of Molecular Modeling

Year:

2011

Language:

english

File:

PDF, 209 KB

english, 2011

34

A MP2 and DFT study of the aromatic character of polyphosphaphospholes. Is the pyramidality the only factor to take into consideration?

Daniela Josa, Angeles Peña-Gallego, Jesús Rodríguez-Otero, Enrique M. Cabaleiro-Lago

Journal:

Journal of Molecular Modeling

Year:

2011

Language:

english

File:

PDF, 267 KB

english, 2011

35

Characterization of Alkane Diol-CD Complexes. Acid Denitrosation ofN-Methyl-N-Nitroso-p-Toluenesulphonamide as a Chemical Probe

Celia Cabaleiro-Lago, Luis García-Río, Pablo Hervés, Juan C. Mejuto, Jorge Pérez-Juste

Journal:

Journal of Inclusion Phenomena and Macrocyclic Chemistry

Year:

2006

Language:

english

File:

PDF, 361 KB

english, 2006

36

The nanoparticle–protein complex as a biological entity; a complex fluids and surface science challenge for the 21st century

Iseult Lynch, Tommy Cedervall, Martin Lundqvist, Celia Cabaleiro-Lago, Sara Linse, Kenneth A. Dawson

Journal:

Advances in Colloid and Interface Science

Year:

2007

Language:

english

File:

PDF, 573 KB

english, 2007

37

Ab Initioand DFT Study of the Influence of the Allene Group on the Diels–Alder Reaction

M. Luisa Ferreiro, Jesús Rodríguez-Otero, Enrique M. Cabaleiro-Lago

Journal:

Structural Chemistry

Year:

2004

Language:

english

File:

PDF, 135 KB

english, 2004

38

An ab initio study of a model compound of penicillins

A. Peña-Gallego, E.M. Cabaleiro-Lago, A. Fernández-Ramos, J.M. Hermida-Ramón, E. Martı́nez-Núñez

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

1999

Language:

english

File:

PDF, 121 KB

english, 1999

39

A DFT study of a model compound of vitamin D

E Martı́nez-Núñez, E.M Cabaleiro-Lago, A Fernández-Ramos, J.M Hermida-Ramón, A Peña-Gallego

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

1999

Language:

english

File:

PDF, 229 KB

english, 1999

40

A quantum chemical study of aniline/ammonia clusters. Thermodynamic properties and frequency analysis

J.M Hermida-Ramón, A Peña-Gallego, E Martı́nez-Núñez, A Fernández-Ramos, E.M Cabaleiro-Lago

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2000

Language:

english

File:

PDF, 172 KB

english, 2000

41

Intermolecular interactions and cooperative effects in acetonitrile clusters. An ab initio molecular orbital study

E.M Cabaleiro-Lago, J.M Hermida-Ramón, A Peña-Gallego, E Martı́nez-Núñez, A Fernández-Ramos

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2000

Language:

english

File:

PDF, 121 KB

english, 2000

42

The Effect of Nanoparticles on Amyloid Aggregation Depends on the Protein Stability and Intrinsic Aggregation Rate

Cabaleiro-Lago, C., Szczepankiewicz, O., Linse, S.

Journal:

Year:

2012

Language:

english

File:

PDF, 378 KB

english, 2012

43

Analysis of the performance of DFT-D, M05-2X and M06-2X functionals for studying π⋯π interactions

Josa, Daniela, Rodríguez-Otero, Jesús, Cabaleiro-Lago, Enrique M., Rellán-Piñeiro, Marcos

Journal:

Chemical Physics Letters

Year:

2013

Language:

english

File:

PDF, 708 KB

english, 2013

44

A MP2 and DFT study of the influence of complexation on the aromatic character of phosphole

Angeles Peña-Gallego, Jesús Rodríguez-Otero, Enrique M. Cabaleiro-Lago

Journal:

Journal of Molecular Modeling

Year:

2012

Language:

english

File:

PDF, 332 KB

english, 2012

45

Theoretical study of the decomposition of ethyl and ethyl 3-phenyl glycidate

Daniela Josa, Angeles Peña-Gallego, Jesús Rodríguez-Otero, Enrique M. Cabaleiro-Lago

Journal:

Journal of Molecular Modeling

Year:

2013

Language:

english

File:

PDF, 192 KB

english, 2013

46

Kinetics of hydrolysis of 4-methoxyphenyl-2,2-dichloroethanoate in binary water?cosolvent mixtures; the role of solvent activity and solute?solute interactions

Rispens, Theo, Cabaleiro-Lago, Celia, Engberts, Jan B. F. N.

Journal:

Organic & Biomolecular Chemistry

Year:

2005

Language:

english

File:

PDF, 176 KB

english, 2005

47

A Potential Function for Intermolecular Interaction in the Acetonitrile Dimer Constructed from ab Initio Data

Cabaleiro-Lago, Enrique M., Ríos, Miguel A.

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 301 KB

english, 1997

48

Effect of microhydration on the guanidinium⋯benzene interaction

Cabaleiro-Lago, Enrique M., Rodríguez-Otero, Jesús, Peña-Gallego, Ángeles

Journal:

The Journal of Chemical Physics

Year:

2011

Language:

english

File:

PDF, 1.37 MB

english, 2011

49

DFT Study of Pericyclic and Pseudopericyclic Thermal Cheletropic Decarbonylations. Evaluation of Magnetic Properties

Rodríguez-Otero, Jesús, Cabaleiro-Lago, Enrique M., Hermida-Ramón, Jose M., Peña-Gallego, Angeles

Journal:

Journal of Organic Chemistry

Year:

2003

Language:

english

File:

PDF, 396 KB

english, 2003

50

Computational study of the dissociation of H–X acids (X=F, Cl, Br, I) in water clusters

Cabaleiro-Lago, Enrique M., Hermida-Ramón, Jose M., Rodrı́guez-Otero, Jesús

Journal:

The Journal of Chemical Physics

Year:

2002

Language:

english

File:

PDF, 648 KB

english, 2002

To build up a library is to create a life. It’s never just a random collection of books.

— Carlos María Domínguez

Official channel

Z-Library Desktop Launcher

Z-Library Since 2009 support@z-lib.do

EnglishРусскийEspañolItalianoελληνικάاللغة العربيةBahasa IndonesiaBahasa Malaysiaहिन्दीDeutschFrançaisPortuguêsУкраїнськаPolski中文繁體中文日本語Tiếng ViệtAzərbaycan DiliՀայոց լեզուภาษาไทยTürk Diliქართველიবাংলাپښتوతెలుగుاردو한국어SrpskiБългарски