Cargando…

Computational Study of the Electron Spectra of Vapor-Phase Indole and Four Azaindoles

After geometry optimization, the electron spectra of indole and four azaindoles are calculated by density functional theory. Available experimental photoemission and excitation data for indole and 7-azaindole are used to compare with the theoretical values. The results for the other azaindoles are p...

Descripción completa

Detalles Bibliográficos
Autor principal:	Chong, Delano P.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2021
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8037839/ https://www.ncbi.nlm.nih.gov/pubmed/33808397 http://dx.doi.org/10.3390/molecules26071947

Ejemplares similares

Catalytic α-Arylation of Imines Leading to N-Unprotected Indoles and Azaindoles
por: Marelli, Enrico, et al.
Publicado: (2016)

Exploring 6-Azaindole and 7-Azaindole Rings for Developing Cannabinoid Receptor 1 Allosteric Modulators
por: Immadi, Sri Sujana, et al.
Publicado: (2018)

The Azaindole Framework in the Design of Kinase Inhibitors
por: Mérour, Jean-Yves, et al.
Publicado: (2014)

Indole and azaindole halogenation catalyzed by the RebH enzyme variant 3-LSR utilizing co-purified E. coli reductase
por: Li, Eunice Hui Yen, et al.
Publicado: (2022)

Approved Small-Molecule ATP-Competitive Kinases Drugs Containing Indole/Azaindole/Oxindole Scaffolds: R&D and Binding Patterns Profiling
por: Zhang, Haofan, et al.
Publicado: (2023)

Regioselective C–H sulfenylation of N-sulfonyl protected 7-azaindoles promoted by TBAI: a rapid synthesis of 3-thio-7-azaindoles
por: Hu, Jingyan, et al.
Publicado: (2020)

Solvent-Free C-3 Coupling of Azaindoles with Cyclic Imines
por: Belasri, Khadija, et al.
Publicado: (2019)

Treatment of Indolent Ulcers by Vapor of Iodine
Publicado: (1860)

Metal-Catalyzed Cross-Coupling Reactions on Azaindole Synthesis and Functionalization
por: Santos, A. Sofia, et al.
Publicado: (2018)

In Vitro Antitumor Active Gold(I) Triphenylphosphane Complexes Containing 7-Azaindoles
por: Štarha, Pavel, et al.
Publicado: (2016)

Pharmacological and Molecular Effects of Platinum(II) Complexes Involving 7-Azaindole Derivatives
por: Štarha, Pavel, et al.
Publicado: (2014)

Deprotometalation-Iodolysis and Direct Iodination of 1-Arylated 7-Azaindoles: Reactivity Studies and Molecule Properties
por: Ameur Messaoud, Mohamed Yacine, et al.
Publicado: (2021)

Stepwise double excited-state proton transfer is not possible in 7-azaindole dimer
por: Crespo-Otero, Rachel, et al.
Publicado: (2015)

Potentiating Effect of UVA Irradiation on Anticancer Activity of Carboplatin Derivatives Involving 7-Azaindoles
por: Štarha, Pavel, et al.
Publicado: (2015)

Highly and Broad-Spectrum In Vitro Antitumor Active cis-Dichloridoplatinum(II) Complexes with 7-Azaindoles
por: Štarha, Pavel, et al.
Publicado: (2015)

Analysis of Vibrational Spectra of Tetrafluoroethane Glasses Deposited by Physical Vapor Deposition
por: Yerezhep, Darkhan, et al.
Publicado: (2023)

Oxidatively induced reactivity in Rh(iii)-catalyzed 7-azaindole synthesis: insights into the role of the silver additive
por: Ryu, Ho, et al.
Publicado: (2022)

Synthesis, Characterization and in Vitro Antitumor Activity of Platinum(II) Oxalato Complexes Involving 7-Azaindole Derivatives as Coligands
por: Štarha, Pavel, et al.
Publicado: (2014)

Platinum(II) Iodido Complexes of 7-Azaindoles with Significant Antiproliferative Effects: An Old Story Revisited with Unexpected Outcomes
por: Štarha, Pavel, et al.
Publicado: (2016)

3,4-Dibromo-7-Azaindole Modulates Arabidopsis Circadian Clock by Inhibiting Casein Kinase 1 Activity
por: Ono, Azusa, et al.
Publicado: (2019)

Microwave-assisted synthesis of 7-azaindoles via iron-catalyzed cyclization of an o-haloaromatic amine with terminal alkynes
por: Le, Yi, et al.
Publicado: (2019)

Two-Dimensional Self-Assembly Driven by Intermolecular Hydrogen Bonding in Benzodi-7-azaindole Molecules on Au(111)
por: Abad, José, et al.
Publicado: (2023)

Dehydrogenation of Ammonia Borane Impacts Valence and Core Electrons: A Photoemission Spectroscopic Study
por: Chong, Delano P., et al.
Publicado: (2022)

G-quadruplex binding properties of a potent PARP-1 inhibitor derived from 7-azaindole-1-carboxamide
por: Dallavalle, Sabrina, et al.
Publicado: (2021)

Synthesis of Chromenoimidazoles, Annulated with an Azaindole Moiety, through a Base-Promoted Domino Reaction of Cyanomethyl Quaternary Salts
por: Voskressensky, Leonid G., et al.
Publicado: (2017)

Synthesis of Blue Emissive Quaternary 9,9-Disubstituted N-Methyl-7-azaindole-Appended (Phenylethynyl)-fluorene Derivatives
por: Smile, Suresh Snoxma, et al.
Publicado: (2023)

Identification and characterization of 7-azaindole derivatives as inhibitors of the SARS-CoV-2 spike-hACE2 protein interaction
por: Wang, Chaojie, et al.
Publicado: (2023)

Stretchable Electronics Based on Laser Structured, Vapor Phase Polymerized PEDOT/Tosylate
por: Aqrawe, Zaid, et al.
Publicado: (2020)

Assessment of Spectra of the Atmospheric Infrared Ultraspectral Sounder on GF-5 and Validation of Water Vapor Retrieval
por: Cao, Xifeng, et al.
Publicado: (2021)

UV-Photoelectron Spectroscopy of BN Indoles: Experimental and Computational Electronic Structure Analysis
por: Chrostowska, Anna, et al.
Publicado: (2014)

Four new indole alkaloids from Plantago asiatica
por: Gao, Zhong-Hua, et al.
Publicado: (2012)

Liquid and Vapor Phase of Four Conifer-Derived Essential Oils: Comparison of Chemical Compositions and Antimicrobial and Antioxidant Properties
por: Garzoli, Stefania, et al.
Publicado: (2021)

Topological Invariants of Vapor–Liquid, Vapor–Liquid–Liquid and Liquid–Liquid Phase Diagrams
por: Frolkova, Anastasia V.
Publicado: (2021)

Organometallic Half-Sandwich Dichloridoruthenium(II) Complexes with 7-Azaindoles: Synthesis, Characterization and Elucidation of Their Anticancer Inactivity against A2780 Cell Line
por: Štarha, Pavel, et al.
Publicado: (2015)

Atlas of electron spin resonance spectra: theoretically calculated multicomponent symmetrical spectra
por: Lebedev, Ya S, et al.
Publicado: (1963)

Atlas of electron spin resonance spectra: theoretically calculated multicomponent symmetrical spectra
por: Lebedev, Ya S, et al.
Publicado: (1964)

Four-dimensional BPS-spectra via M-theory
por: Henningson, Mans, et al.
Publicado: (1997)

BPS-spectra in four dimensions from M-theory
por: Henningson, Mans
Publicado: (1997)

The theory of the electronic spectra of organic molecules
por: Murrell, John Norman
Publicado: (1963)

Atlas of electron spin resonance spectra
por: Bielski, Benon H J, et al.
Publicado: (1967)

Cannot write session to /tmp/vufind_sessions/sess_3aph0443hpmu3rm0a1t6m7geo2