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Extending the Molecular Electron Density Theory

Project description

Evolving molecular electron density theory for studying organic molecule reactions

The breaking and forming of chemical bonds in chemical reactions is associated with the depletion and accumulation of electron density between atoms. The recently proposed molecular electron density theory delineates the role of electron density changes in the reactivity of organic molecules. Building on the new chemical insights obtained by the application of this theory to pericyclic reactions and 1,3-dipolar cycloaddition reactions, the Extending MEDT project, funded under the Marie Skłodowska-Curie Actions programme, aims to further develop molecular electron density theory and design more precise computational tools. The project's ultimate goal is to prove that it is a preferable theory for describing the chemical reactivity of organic molecules.

Coordinator

UNIVERSITAT DE VALENCIA
Net EU contribution
€ 232 497,60
Address
Avenida Blasco Ibanez 13
46010 Valencia
Spain

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Region
Este Comunitat Valenciana Valencia/València
Activity type
Higher or Secondary Education Establishments
Other funding
€ 0,00

Partners (1)

Partner

Partner organisations contribute to the implementation of the action, but do not sign the Grant Agreement.

MCMASTER UNIVERSITY
Canada
Net EU contribution
€ 0,00
Address
1280 Main St West
L8S 4L8 Hamilton

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Activity type
Higher or Secondary Education Establishments
Other funding
€ 152 031,36