ArticleMolecules (Basel, Switzerland)2023
Computational Insights into Excited State Intramolecular Double Proton Transfer Behavior Associated with Atomic Electronegativity for Bis(2'-benzothiazolyl)hydroquinone.
Article in Molecules (Basel, Switzerland), 2023. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 7 papers.
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Who cites it
7 citing papers in PubMed, 65 citations in OpenAlex.
- Solvent polarity and chalcogen electronegativity synergistically regulate excited-state proton transfer in BBYPD derivatives.Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology · 2026Article
- Theoretical uncovering of the chalcogen element regulated ESDPT behaviors for 2,5-bis(2-benzoxazolyl)-hydroquinone derivatives.RSC advances · 2024Article
- Theoretical investigation of the excited-state intramolecular double proton transfer process of 2,2'-(benzo[1,2-RSC advances · 2024Article
- Computational explorations about the solvent-polarity-associated excited state proton transfer behaviors for the novel F-BSD compound.Journal of molecular modeling · 2024Article
- Computational Investigation about the Effects of Solvent Polarity and Chalcogen Element Electronegativity on ESIPT Behaviors for the EtMolecules (Basel, Switzerland) · 2024Article
- Modulating the ESIPT Mechanism and Luminescence Characteristics of Two Reversible Fluorescent Probes by Solvent Polarity: A Novel Perspective.Molecules (Basel, Switzerland) · 2024Article
- Effects of Chalcogen Atoms on Excited-State Double-Proton Transfer Behavior for 3,6-bis(4,5-Dihydroxyoxazo-2-yl)benzene-1,2-diol Derivatives: A Computational Investigation.Molecules (Basel, Switzerland) · 2024Article
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Authors and funding
2 authors at 1 institution in 1 country.
Funding
Abstract
Inspired by the distinguished regulated photochemical and photophysical properties of 2-(2'-hydroxyphenyl)benzazole derivatives, in this work, the novel bis(2'-benzothiazolyl)hydroquinone (BBTHQ) fluorophore is explored, looking at its photo-induced behaviors associated with different substituted atomic electronegativities, i.e., BBTHQ-SO, BBTHQ-SS and BBTHQ-Se compounds. From the structural changes, infrared (IR) vibrational variations and simulated core-valence bifurcation (CVB) indexes for the dual hydrogen bonds for the three BBTHQ derivatives, we see that low atomic electronegativity could be conducive to enhancing hydrogen bonding effects in the S
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Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.