0000000000704353

AUTHOR

Alejandro Ortíz

0000-0002-4392-9456

showing 2 related works from this author

Aminopyrimidine-Based Donor–Acceptor Chromophores: Push–Pull versus Aromatic Behaviour

2008

Novel 2-aminopyrimidines substituted with two electron-donor dialkylamino groups and either one dicyanovinyl (4a–d) or one tricyanovinyl (7a–d) electron-acceptor group have been synthesized, and the balance between their push–pull character and their aromatic behaviour has been studied by experimental (spectroscopic, electrochemical and X-ray analysis) and theoretical (DFT/B3LYP/6-31G**) methods. Calculations reveal that the push–pull character is energetically favoured with respect to the preservation of the aromaticity of the pyrimidine ring. X-ray analysis of 7a confirms the theoretical predictions and reveals a strong distortion from planarity due to the steric interaction between the t…

Steric effectsCrystallographyChemistryComputational chemistryIntramolecular forceOrganic ChemistryMoleculeAromaticityPhysical and Theoretical ChemistryChromophoreRing (chemistry)HOMO/LUMOAcceptorEuropean Journal of Organic Chemistry
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Azatruxene‐Based, Dumbbell‐Shaped, Donor–π‐Bridge–Donor Hole‐Transporting Materials for Perovskite Solar Cells

2020

Three novel donor-π-bridge-donor (D-π-D) hole-transporting materials (HTMs) featuring triazatruxene electron-donating units bridged by different 3,4-ethylenedioxythiophene (EDOT) π-conjugated linkers have been synthesized, characterized, and implemented in mesoporous perovskite solar cells (PSCs). The optoelectronic properties of the new dumbbell-shaped derivatives (DTTXs) are highly influenced by the chemical structure of the EDOT-based linker. Red-shifted absorption and emission and a stronger donor ability were observed in passing from DTTX-1 to DTTX-2 due to the extended π-conjugation. DTTX-3 featured an intramolecular charge transfer between the external triazatruxene units and the azo…

Electron mobilityPhotoluminescence010405 organic chemistryChemistryOrganic ChemistryEnergy conversion efficiencyGeneral ChemistryConductivity010402 general chemistry01 natural sciencesCatalysis0104 chemical sciencesCrystallographyIntramolecular forceMesoporous materialAbsorption (electromagnetic radiation)Perovskite (structure)Chemistry – A European Journal
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