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Molecular Structure and Reactivity

Grupo consolidado

Acrónimo:
MolesS-ReaC
Coordinadores:
MANUEL YAÑEZ MONTERO
Palabras clave:
Beryllium bonds. Non-covalent interactions. Covalent organic frameworks. Metal-organic-frameworks. Gas-storage.
Enlaces:
https://moles-reac.qui.uam.esMaster studies in Theoretical Chemistry and Computational modelling
https://tccm.qui.uam.es/?page_id=1419
https://emtccm.qui.uam.es/

Líneas de investigación

- New non-covalent interactions arising when B and P is replaced by Al and/or Ga in amineboranes and phosphineboranes. - The so- called "beryllium bonds" whose existence was proposed recently by our two teams and which exhibit several common features with the conventional hydrogen bonds. - Very strong non-covalent interactions leading to the formation of metallocycles and which can be somehow related with metal-organic-frameworks (MOFs) used in gas-storage. - Non-covalent interactions involved in the building up of metal-organic-frameworks (MOF) or covalent organic frameworks (COFs) systems with gas-storage (Hydrogen, CO2,...) capacity. - Non-covalent interactions associated with ditopic systems as possible building blocks of new materials.- Frustrated Lewis pairs, some of which may exhibit also gas-storage capacity.

Miembros

MANUEL YAÑEZ MONTERO
AL MOKHTAR LAMSABHI BELMEKNASSI
DMYTRO IVASHCHENKO
ENRIQUE MANUEL ARPA GONZALEZ
EVA VOS ESTEBAN
IBON ALKORTA OSORO
INES CORRAL PEREZ
Mª. DE LA MERCED MONTERO CAMPILLO
MARTINA DE VETTA
NEUS AGUILERA PORTA
OTILIA MO ROMERO
PABLO SANZ MERCADO
 
Miembros Asociados
Externos/Máster UAM
Iñigo Iribarren Aguirre
I-ting Tsai

Publicaciones

Publicaciones más relevantes

- Gavin S. Heverly-Coulson, Russell J. Boyd, Otilia Mó and Manuel Yáñez. "Revealing unexpected mechanisms for nucleophilic attack on S-S and Se-Se bridges". Chemistry-A European Journal 19, 3629-3638 (2013). - Manuel Yáñez, Otilia Mó, Ibon Alkorta, José Elguero. "Can conventional Bases and Unsaturated Hydrocarbons be converted into gas-phase Superacids that are stronger than most of the known Oxyacids? The role of Berillium Bonds". Chemistry-A European Journal 19, 11637-11643 (2013). - M. Montero-Campillo, M. Yáñez, A-M. Lamsabhi, and O. Mó. "Spontaneous H2 Loss through the Interaction of Squaric Acid Derivatives and BeH2". Chemistry-A European Journal 20, 5309-5316 (2014). - Julia Guilleme, Lara Martínez-Fernández, David González-Rodriguez, Inés Corral, Manuel Yáñez, and Tomás Torres. "An Insight into the Mechanism of the Axial Ligand Exchange Reaction in Boron Subphthalocyanine Macrocycles". Journal of the American Chemical Society 136, 14289-14298 (2014). - Oriana Brea, Ibon Alkorta, Otilia Mó, Manuel Yáñez, José Elguero, Inés Corral. "Exergonic and spontaneous production of radicals through beryllium bonds". Angew. Chem. Int. Ed. 55, 8736-8739 (2016). - Elena Kusevska, M.Merced. Montero-Campillo, Otilia Mó and Manuel Yáñez. "One-Electron Bonds in Frustrated Lewis Pair TPB Ligands: Boron Behaving as A Lewis Base". Angew. Chem. Int. Ed.,56, 6788-6792 (2017).

Proyectos

Proyectos más relevantes

- CONSOLIDER on "Molecular Nanoscience". Funded by DGI-MEC (ref. CSD 2007-00010). From 2007 to 2011. Coordinator: Eugenio Coronado. - ERASMUS MUNDUS "European Joint Master in Theoretical Chemistry and Computational Modelling (TCCM)". Funded by European Commission. EACEA (ref. EMMC FPA 2010-0147). From 2010 to 2019. Coordinator: Manuel Yáñez. - EUOPEAN JOIN DOCTORATE "Theoretical Chemistry and Computational Modelling (TCCM)". Funded by European Commission. Research Executive Agency (MSCA-ITN-EJD GA 642294). From 2015 to 2019. Coordinator: Manuel Yáñez. - "Materiales Avanzados de Carbono para Fotovoltaica Molecular (FOTOCARBON)";. Funded by Dirección General de Universidades e Investigación. Consejería de Educación, CAM (ref. S2013/MIT-2841). From 2014 to 2018. Coordinator: Nazario Martín. - "Modificación de la Reactividad y Diseño de Nuevos Materiales mediante Enlaces de Berilio y otras Interacciones No-Covalentes". Funded by DGICT CTQ2015-63997-C2-1-P. From 2016 to 2019. Principal Investigator: Manuel Yáñez.