Optoelectronic Response to the Fluor Ion Bond on 4-(4,4,5,5-Tetramethyl-1,3,2-dioxoborolan-2-yl)benzaldehyde.


Journal

International journal of molecular sciences
ISSN: 1422-0067
Titre abrégé: Int J Mol Sci
Pays: Switzerland
ID NLM: 101092791

Informations de publication

Date de publication:
03 May 2024
Historique:
received: 19 02 2024
revised: 08 04 2024
accepted: 11 04 2024
medline: 11 5 2024
pubmed: 11 5 2024
entrez: 11 5 2024
Statut: epublish

Résumé

Boronate esters are a class of compounds containing a boron atom bonded to two oxygen atoms in an ester group, often being used as precursors in the synthesis of other materials. The characterization of the structure and properties of esters is usually carried out by UV-visible, infrared, and nuclear magnetic resonance (NMR) spectroscopic techniques. With the aim to better understand our experimental data, in this article, the density functional theory (DFT) is used to analyze the UV-visible and infrared spectra, as well as the isotropic shielding and chemical shifts of the hydrogen atoms

Identifiants

pubmed: 38732218
pii: ijms25095000
doi: 10.3390/ijms25095000
pii:
doi:

Substances chimiques

Benzaldehydes 0
Fluorine 284SYP0193
Boron N9E3X5056Q
Esters 0
Ions 0

Types de publication

Journal Article

Langues

eng

Sous-ensembles de citation

IM

Subventions

Organisme : Agencia Nacional de Investigación y Desarrollo
ID : SA77210040
Organisme : DIUFRO
ID : DI23-0026

Auteurs

Ulises J Guevara (UJ)

Instituto de Alta Investigación, Universidad de Tarapacá, Arica 1000000, Chile.

Jesús Núñez (J)

Departamento de Biología, Universidad Politécnica Territorial del Oeste de Sucre "Clodosbaldo Russian", Cumaná 6101, Venezuela.

Laura M Pérez (LM)

Departamento de Ingeniería Industrial y de Sistemas, Universidad de Tarapacá, Arica 1000000, Chile.

Anton Tiutiunnyk (A)

Departamento de Física, FACI, Universidad de Tarapacá, Arica 1000000, Chile.

Neudo Urdaneta (N)

Departamento de Química, Universidad Simón Bolívar (USB), Caracas 1020-A, Venezuela.

Eduardo Cisternas (E)

Departamento de Ciencias Físicas, Universidad de La Frontera, Casilla 54-D, Temuco 4811230, Chile.

David Laroze (D)

Instituto de Alta Investigación, Universidad de Tarapacá, Arica 1000000, Chile.

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Classifications MeSH