E-LIB Suche - Ergebnisse für: Herrera, Bárbara

1

Substitution Effects in Aryl Halides and Amides into the Re..:

Durán, Rocío ; Barrales-Martínez, César ; Santana-Romo, Fabián...
Molecules. 29 (2024) 8 - p. 1770 , 2024

2

Basis Electronic Activity of Molecular Systems. A Theory of..:

Benítez, Francisca J. ; Gutiérrez-Oliva, Soledad ; Herrera, Bárbara.
The Journal of Physical Chemistry A. 128 (2024) 10 - p. 1902-1912 , 2024

Link: https://doi.org/10.1021/..

3

Antioxidant Capacity of Free and Peptide Tryptophan Residue..:

Figueroa, Juan David ; Barroso-Torres, Noreima ; Morales, Marcela...
Foods. 12 (2023) 23 - p. 4360 , 2023

Link: https://doi.org/10.3390/..

4

Digging on the mechanism of some Diels–Alder reactions: the..:

Hernández-Mancera, Jennifer Paola ; Vivas-Reyes, Ricardo ; Gutiérrez-Oliva, Soledad..
Theoretical Chemistry Accounts. 142 (2023) 8 - p. , 2023

Link: https://doi.org/10.1007/..

5

The study of the PES and the reaction mechanism between ket..:

Villablanca, Daniel ; Gazzari, Sasha ; Herrera, Bárbara
Theoretical Chemistry Accounts. 142 (2023) 4 - p. , 2023

Link: https://doi.org/10.1007/..

6

Complexation of AAPH (2,2′-azobis(2-methylpropionamidine) d..:

Forero-Girón, Angie C. ; Fuentealba, Denis ; Mariño-Ocampo, Nory...
Journal of Molecular Liquids. 389 (2023) - p. 122840 , 2023

Link: https://doi.org/10.1016/..

7

Theoretical study of the substituent effect on the O–H inse..:

Durán, Rocío ; Herrera, Barbara
Theoretical Chemistry Accounts. 141 (2022) 3 - p. , 2022

Link: https://doi.org/10.1007/..

8

A surface functionalized with per-(6-amino-6-deoxy)-β-cyclo..:

Herrera, Bárbara A. ; Bruna, Tamara C. ; Sierpe, Rodrigo A....
Carbohydrate Polymers. 233 (2020) - p. 115865 , 2020

Link: https://doi.org/10.1016/..

9

On the nature of the interaction of copper hydride and hali..:

Arslancan, Serra ; Herrera, Barbara ; Lamsabhi, Al Mokhtar
Journal of Molecular Modeling. 26 (2020) 3 - p. , 2020

Link: https://doi.org/10.1007/..

10

Theoretical Study of the Mechanism of Catalytic Enanteosele..:

Durán, Rocío ; Herrera, Barbara
The Journal of Physical Chemistry A. 124 (2019) 1 - p. 2-11 , 2019

Link: https://doi.org/10.1021/..

11

Theoretical study of C-arylations with aryl halides to dete..:

Durán, Rocío ; Núñez-Navarro, Nicolás ; Zacconi, Flavia C..
Physical Chemistry Chemical Physics. 21 (2019) 19 - p. 10163-10170 , 2019

Link: https://doi.org/10.1039/..

12

Mechanistic Insight toward Understanding the Role of Charge..:

Smajlagic, Ivor ; Guest, Matt ; Durán, Rocío..
The Journal of Organic Chemistry. 85 (2019) 2 - p. 585-593 , 2019

Link: https://doi.org/10.1021/..

13

Reaction Electronic Flux Perspective on the Mechanism of th..:

Matute, Ricardo A. ; Pérez, Patricia ; Chamorro, Eduardo...
The Journal of Organic Chemistry. 83 (2018) 11 - p. 5969-5974 , 2018

Link: https://doi.org/10.1021/..

14

An extension of the Marcus equation: the Marcus potential e..:

Gutiérrez-Oliva, Soledad ; Herrera, Bárbara ; Toro-Labbé, Alejandro
Journal of Molecular Modeling. 24 (2018) 4 - p. , 2018

Link: https://doi.org/10.1007/..

15

Elucidating the Catalytic Role of Mg(II) in the Intramolecu..:

Vogt-Geisse, Stefan ; Gutiérrez-Oliva, Soledad ; Herrera, Bárbara.
Journal of the Mexican Chemical Society. 56 (2017) 3 - p. , 2017

Link: https://doi.org/10.29356..