Cargando…

Visualizing electron delocalization in contorted polycyclic aromatic hydrocarbons

Electron delocalization in contorted polycyclic aromatic hydrocarbon (PAH) molecules was examined through 3D isotropic magnetic shielding (IMS) contour maps built around the molecules using pseudo-van der Waals surfaces. The resulting maps of electron delocalization provided an intuitive, yet detail...

Descripción completa

Detalles Bibliográficos
Autores principales:	Artigas, Albert, Hagebaum-Reignier, Denis, Carissan, Yannick, Coquerel, Yoann
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	The Royal Society of Chemistry 2021
Materias:	Chemistry
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8513938/ https://www.ncbi.nlm.nih.gov/pubmed/34745540 http://dx.doi.org/10.1039/d1sc03368a

Ejemplares similares

Contorted Polycyclic Aromatic Hydrocarbons with Two Embedded Azulene Units
por: Yang, Xuan, et al.
Publicado: (2019)

Wave-shaped polycyclic hydrocarbons with controlled aromaticity
por: Ma, Ji, et al.
Publicado: (2019)

One-pot syntheses of irida-polycyclic aromatic hydrocarbons
por: Hu, Yu Xuan, et al.
Publicado: (2019)

Understanding the reactivity of polycyclic aromatic hydrocarbons and related compounds
por: Fernández, Israel
Publicado: (2020)

The degree and source of plastic recyclates contamination with polycyclic aromatic hydrocarbons
por: Alassali, Ayah, et al.
Publicado: (2020)

Correction: One-pot syntheses of irida-polycyclic aromatic hydrocarbons
por: Hu, Yu Xuan, et al.
Publicado: (2019)

Polycyclic Aromatic Hydrocarbons as Plausible Prebiotic Membrane Components
por: Groen, Joost, et al.
Publicado: (2012)

Aromaticity Determines the Relative Stability of Kinked vs. Straight Topologies in Polycyclic Aromatic Hydrocarbons
por: Poater, Jordi, et al.
Publicado: (2018)

Formation pathways of polycyclic aromatic hydrocarbons (PAHs) in butane or butadiene flames
por: Zhang, Tingting, et al.
Publicado: (2021)

Polycyclic aromatic hydrocarbons in carcinogenesis.
por: Warshawsky, D
Publicado: (1999)

Induction and inhibition of human cytochrome P4501 by oxygenated polycyclic aromatic hydrocarbons
por: Wincent, Emma, et al.
Publicado: (2016)

A polycyclic aromatic hydrocarbon diradical with pH-responsive magnetic properties
por: Fu, Xiangyu, et al.
Publicado: (2020)

Aramid-wrapped CNT hybrid sol–gel sorbent for polycyclic aromatic hydrocarbons
por: Alhendal, Abdullah, et al.
Publicado: (2022)

Comprehending radicals, diradicals and their bondings in aggregates of imide-fused polycyclic aromatic hydrocarbons
por: Liu, Jiani, et al.
Publicado: (2022)

Polycyclic aromatic hydrocarbons in permafrost peatlands
por: Pastukhov, Alexander, et al.
Publicado: (2021)

Polycyclic aromatic hydrocarbons and cancer in man.
por: Mastrangelo, G, et al.
Publicado: (1996)

Polycyclic aromatic hydrocarbons in soybean grains
por: Pereira Silva, Rosana Maria, et al.
Publicado: (2020)

Effect of polycyclic aromatic hydrocarbons on immunity
por: Yu, Yang-yiyi, et al.
Publicado: (2022)

Photoredox Annulation of Polycyclic Aromatic Hydrocarbons
por: Zanetti, Davide, et al.
Publicado: (2023)

Quantitative Structure–Property Relationships for the Electronic Properties of Polycyclic Aromatic Hydrocarbons
por: Nguyen, Lam H., et al.
Publicado: (2018)

Comparative Analysis of Polycyclic Aromatic Hydrocarbons and Halogenated Polycyclic Aromatic Hydrocarbons in Different Parts of Perilla frutescens (L.) Britt.
por: Wang, Pengfei, et al.
Publicado: (2022)

Benchmark calculations for bond dissociation energies and enthalpy of formation of chlorinated and brominated polycyclic aromatic hydrocarbons
por: Xu, Shenying, et al.
Publicado: (2021)

Knitting polycyclic aromatic hydrocarbon-based microporous organic polymers for efficient CO(2) capture
por: Hou, Shuangshuang, et al.
Publicado: (2018)

Polycyclic aromatic hydrocarbon growth in a benzene discharge explored by IR-UV action spectroscopy
por: Lemmens, Alexander K., et al.
Publicado: (2022)

Mutagenic and carcinogenic properties of polycyclic aromatic hydrocarbons.
por: Pashin, Y V, et al.
Publicado: (1979)

Transformation of polycyclic aromatic hydrocarbons during sampling.
por: Lindskog, A
Publicado: (1983)

Extraction Techniques for Polycyclic Aromatic Hydrocarbons in Soils
por: Lau, E. V., et al.
Publicado: (2010)

An Approach to the Synthesis of Functionalized Polycyclic Aromatic Hydrocarbons
por: Little, Mark, et al.
Publicado: (2013)

Extended O‐Doped Polycyclic Aromatic Hydrocarbons
por: Stassen, Daphné, et al.
Publicado: (2016)

Surfactant-mediated Biodegradation of Polycyclic Aromatic Hydrocarbons
por: Li, Jing-Liang, et al.
Publicado: (2009)

Toxicities of Polycyclic Aromatic Hydrocarbons for Aquatic Animals
por: Honda, Masato, et al.
Publicado: (2020)

Recent Evidence on Polycyclic Aromatic Hydrocarbon Exposure
por: Zhao, Xiaohan, et al.
Publicado: (2023)

Aggregation-Induced Emission of Contorted Polycondensed Aromatic Hydrocarbons Made by Edge Extension Using a Palladium-Catalyzed Cyclopentannulation Reaction
por: Baig, Noorullah, et al.
Publicado: (2022)

Emission Characteristics of Polycyclic Aromatic Hydrocarbons and Nitro-Polycyclic Aromatic Hydrocarbons from Open Burning of Rice Straw in the North of Vietnam
por: Pham, Chau-Thuy, et al.
Publicado: (2019)

Real space electron delocalization, resonance, and aromaticity in chemistry
por: Reuter, Leonard, et al.
Publicado: (2021)

Electron Delocalization in Planar Metallacycles: Hückel or Möbius Aromatic?
por: Szczepanik, Dariusz W., et al.
Publicado: (2019)

Immunofluorescence Visualization of Polycyclic Aromatic Hydrocarbon Mixtures in the Eastern Oyster Crassostrea virginica
por: Prossner, Kristen M., et al.
Publicado: (2023)

A topological model for predicting adsorption energies of polycyclic aromatic hydrocarbons on late-transition metal surfaces
por: Ding, Zhao-Bin, et al.
Publicado: (2019)

Synthesis of functionalized nitrogen-containing polycyclic aromatic hydrocarbons and other prebiotic compounds in impacting glycine solutions
por: Kroonblawd, Matthew P., et al.
Publicado: (2019)

A sensor array for the discrimination of polycyclic aromatic hydrocarbons using conjugated polymers and the inner filter effect
por: Tropp, Joshua, et al.
Publicado: (2019)

Cannot write session to /tmp/vufind_sessions/sess_j2n6qdfah81ujcm1rjv43fjfdc