Reactivity of First-Row Transition Metal Monocations (Sc+, Ti+, V+, Zn+) with Methyl Fluoride: A Computational Study
The gas-phase reactivity of methyl fluoride with selected first-row transition metal
monocations (Sc+, Ti+, V+, and Zn+) has been theoretically investigated. Our …
monocations (Sc+, Ti+, V+, and Zn+) has been theoretically investigated. Our …
Photofragment imaging from mass-selected ions using a reflectron mass spectrometer. II: Formation mechanism of MgF+ in the photodissociation of Mg+ FCH3 …
We have observed fragment-ion images by ultraviolet photodissociation of Mg+ single
bondFCH 3 complex using a reflectron time-of-flight mass spectrometer coupled with an …
bondFCH 3 complex using a reflectron time-of-flight mass spectrometer coupled with an …
Halogen-abstraction reactions from chloromethane and bromomethane molecules by alkaline-earth monocations
P Redondo, A Largo, VM Rayón… - Physical Chemistry …, 2014 - pubs.rsc.org
The reactions, in the gas phase, between alkali-earth monocations (Mg+, Ca+, Sr+, Ba+)
and CH3X (X= Cl, Br) have been theoretically studied. The stationary points on the potential …
and CH3X (X= Cl, Br) have been theoretically studied. The stationary points on the potential …
Kinetics Studies of the Reactions of Main Fourth-Period Monocations (Ga+, Ge+, As+, and Se+) with Methyl Fluoride
C Barrientos, VM Rayón, A Largo… - The Journal of …, 2013 - ACS Publications
Thermodynamics and kinetics theoretical studies on the gas-phase reactions of
fluoromethane with main fourth-period monocations (Ga+, Ge+, As+, and Se+) have been …
fluoromethane with main fourth-period monocations (Ga+, Ge+, As+, and Se+) have been …
Fundamental Aspects of the Metal‐Catalyzed C–H Bond Functionalization by Diazocarbenes: Guiding Principles for Design of Catalyst with Non‐redox‐Active Metal …
We analyzed electronic factors affecting the mechanism of metal‐catalyzed C–H bond
alkylation by diazocarbene precursors. The analyses showed that e efficient metal …
alkylation by diazocarbene precursors. The analyses showed that e efficient metal …
Modelización computacional de la reactividad química: reacción de Ge++ CH3X (Cl, Br)
J Abellán Burgos - 2016 - uvadoc.uva.es
Se ha llevado a cabo un estudio computacional para las reacciones del catión germanio
con clorometano y bromometano. El estudio se ha realizado dentro del contexto de la teoría …
con clorometano y bromometano. El estudio se ha realizado dentro del contexto de la teoría …
Activación de enlaces carbono-halógeno por cationes metálicos: estudio de la reacción (Zn+)+(CH3Cl)
A Ruiz Echávarri - 2015 - uvadoc.uva.es
Se ha llevado a cabo un estudio teórico-computacional sobre la reacción Zn++ CH3Cl. El
estudio se ha realizado dentro del contexto de la teoría del funcional de la densidad (DFT) …
estudio se ha realizado dentro del contexto de la teoría del funcional de la densidad (DFT) …
Activation de liens CF à l'aide de liaisons hydrogène
PA Champagne - 2015 - library-archives.canada.ca
L'activation de liens CF a été un sujet de recherche prolifique des dix dernières années,
considérant l'utilité de telles études pour mieux comprendre et utiliser le comportement des …
considérant l'utilité de telles études pour mieux comprendre et utiliser le comportement des …