Design of large Stokes shift fluorescent ortho-bis-styrylbenzenes.

This study combines underexplored fluorescent structures with large Stokes shifts, such as ortho-derivatives of bis(styryl)benzenes, for detecting three anions (fluoride, cyanide, and hydroxyl) through the implementation of fluorescent molecular logic gates. Importantly, this approach allows for the...

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Detalhes bibliográficos
Autores: Lera Garrido, Fernando Juan de, Vázquez Villar, Víctor, Fernández Liencres, M. Paz, Sánchez Ruiz, Antonio, Navarro Rascón, Amparo, Tolosa Barrilero, Juan, García Martínez, Joaquín Calixto
Formato: artículo
Fecha de publicación:2024
País:España
Recursos:Universidad de Castilla-La Mancha
Repositorio:RUIdeRA. Repositorio Institucional de la UCLM
OAI Identifier:oai:ruidera.uclm.es:10578/43034
Acesso em linha:https://hdl.handle.net/10578/43034
Access Level:acceso abierto
Palavra-chave:Fluorescent structures
Large Stokes shifts
Ortho-bis-styrylbenzenes
Optical properties
Descrição
Resumo:This study combines underexplored fluorescent structures with large Stokes shifts, such as ortho-derivatives of bis(styryl)benzenes, for detecting three anions (fluoride, cyanide, and hydroxyl) through the implementation of fluorescent molecular logic gates. Importantly, this approach allows for the detection of multiple analytes and discrimination between analytes with closely similar behaviours, reducing the need for sample pre-treatments and enhancing efficiency in complex environmental analyses. Compounds with large Stokes shifts are essential in spectroscopy, offering reduced self-absorption, improved sensitivity, minimal spectral overlap, better resolution, and interference-free use of multiple fluorescent compounds. Therefore, we present a study on how the substitution of these oBSB compounds influences their optical properties. Through Time-Dependent Density Functional Theory (TD-DFT) calculations, we gain comprehensive insights into the molecular structure and photophysical properties, elucidating the exceptional Stokes shift exhibited by these compounds. Additionally, our findings offer a deeper understanding of the electronic states and changes in molecular geometry that contribute to their unique optical behaviour. Finally, the appropriate analysis of the fluorescent responses of these compounds as inputs in logic gates allows the detection of fluoride, cyanide, or hydroxyl anions in an unknown sample.