Search Results - "Rojas‐Poblete, Macarena"

Role of donor‐acceptor functional groups in N3P3 cyclic‐triphosphazene backbone. Unraveling bonding characteristics from natural orbitals within an extended transition state‐natural orbital for the chemical valence scheme by Linares‐Flores, Cristian, Ramirez‐Tagle, Rodrigo, Rojas‐Poblete, Macarena, Arratia‐Perez, Ramiro, Muñoz‐Castro, Alvaro, Guajardo‐Maturana, Raul

“…The formation of cyclophosphazenes containing several ligands or substituent groups gives rise to an attractive derivative set, for development of novel…”
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Electronic pathway of the exciplex emitters. Unraveling the emission properties from theoretical calculations by Claveria-Cadiz, Francisca, Rojas-Poblete, Macarena, Muñoz-Castro, Alvaro, Schott, Eduardo, Guajardo-Maturana, Raúl

“…[Display omitted] •Exciplex compounds, theoretical calculations to unraveling the excited fluorescence mechanism.•Exciplexes: electronic structure toward OLED…”
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Nature and role of formal charge of the ion inclusion in hexanuclear Platinum(II) Host-Guest Species. Insights from relativistic DFT calculations by Rojas-Poblete, Macarena, Rodríguez-Kessler, Peter L., Guajardo-Maturana, Raul, Olea Ulloa, Carolina, Muñoz-Castro, Alvaro

“…[Display omitted] •Noncovalent interaction towards Pt6 metallacycle.•Evaluation of cation charge into interaction energy.•Structural changes.•Optical…”
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4′–phenyl −2, 2′: 6′, 2′’-terpyridine derivatives as metal chemosensors. Chelation and fluorescence capabilities towards Zn(II), Cd(II), and Hg(II) from experiment and theory by Rojas-Poblete, Macarena, Guajardo-Maturana, Raúl, Velásquez, Luis, Cantero-López, Plinio, Muñoz-Castro, Álvaro

“…•4′-phenylterpyridine, synthesis, and theoretical studies toward metal-sensor properties.•4′-phenylterpyridine derivatives are multifunctional chemosensor of…”
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Design of new porous supramolecular arrays from flavyliums derivative linker. A theoretical assemble toward surface properties by Linares-Flores, Cristian, Rojas-Poblete, Macarena, Guajardo-Maturana, Raul, Velasquez, Luis, Schott, Eduardo

“…[Display omitted] •Design and characterizations of frameworks structures, including structural and surface properties.•MOFs structures, quantification of…”
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Easy and rapid preparation of benzoylhydrazides and their diazene derivatives as inhibitors of 15-lipoxygenase by Tirapegui, Cristian, Acevedo-Fuentes, Williams, Dahech, Pablo, Torrent, Claudia, Barrias, Pablo, Rojas-Poblete, Macarena, Mascayano, Carolina

“…[Display omitted] Two series of diaza derivatives were prepared by solvent-free condensation of benzoic acid and 4-substituted phenylhydrazines in order to…”
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Optical and electronic properties of benzopyrylium derivatives. Theoretical-experimental synergy towards novel DSSCs devices by Tirapegui, Cristian, Rojas-Poblete, Macarena, Arratia-Perez, Ramiro, Linares-Flores, Cristian, Islas, Rafael, Schott, Eduardo, Guajardo-Maturana, Raul

“…Here, we discuss the formation of several heterocyclic benzopyrylium compounds via joint experimental-theoretical efforts, in order to obtaining a better…”
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Role of donor‐acceptor functional groups in N 3 P 3 cyclic‐triphosphazene backbone. Unraveling bonding characteristics from natural orbitals within an extended transition state‐natural orbital for the chemical valence scheme by Linares‐Flores, Cristian, Ramirez‐Tagle, Rodrigo, Rojas‐Poblete, Macarena, Arratia‐Perez, Ramiro, Muñoz‐Castro, Alvaro, Guajardo‐Maturana, Raul

“…Abstract The formation of cyclophosphazenes containing several ligands or substituent groups gives rise to an attractive derivative set, for development of…”
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Corrigendum to ‘Easy and rapid preparation of benzoylhydrazides and their diazene derivatives as inhibitors of 15-lipoxygenase’ [Bioorg. Med. Chem. Lett. 27 (2017) 1649–1653] by Tirapegui, Cristian, Acevedo-Fuentes, Williams, Dahech, Pablo, Torrent, Claudia, Barrias, Pablo, Rojas-Poblete, Macarena, Mascayano, Carolina

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