Results 21 to 30 of about 40,114 (276)

Hydrogenated polycyclic aromatic hydrocarbons: isomerism and aromaticity

open access: yesPhysical Chemistry Chemical Physics, 2020
A simple model based on adjacency matrices is introduced to study the stability of hydrogenated polycyclic aromatic hydrocarbons. Aromaticity governs their relative stability having the most stable isomers the higher number of non-hydrogenated rings.
Paula Pla   +3 more
openaire   +3 more sources

Hyperconjugative aromaticity and protodeauration reactivity of polyaurated indoliums

open access: yesNature Communications, 2019
Hyperconjugative aromaticity combines the concepts of hyperconjugation and aromaticity and explains cyclopentadiene stability. Here, the authors demonstrate extended hyperconjugative aromaticity in a metallated indole ring, which shows extended electron ...
Kui Xiao, Yu Zhao, Jun Zhu, Liang Zhao
doaj   +1 more source

From mass to structure: An aromaticity index for high-resolution mass data of natural organic matter [PDF]

open access: yes, 2006
Recent progress in Fourier transform ion cyclotron resonance mass spectrometry (FTICRMS) provided extensive molecular mass data for complex natural organic matter (NOM). Structural information can be deduced solely from the molecular masses for ions with
Benecke   +16 more
core   +1 more source

Aromaticity as a Guiding Concept for Spectroscopic Features and Nonlinear Optical Properties of Porphyrinoids

open access: yesMolecules, 2018
With their versatile molecular topology and aromaticity, porphyrinoid systems combine remarkable chemistry with interesting photophysical properties and nonlinear optical properties.
Tatiana Woller   +4 more
doaj   +1 more source

The Silacyclobutene Ring: An Indicator of Triplet State Baird-Aromaticity

open access: yesInorganics, 2017
Baird’s rule tells that the electron counts for aromaticity and antiaromaticity in the first ππ* triplet and singlet excited states (T1 and S1) are opposite to those in the ground state (S0). Our hypothesis is that a silacyclobutene (SCB) ring fused with
Rabia Ayub   +2 more
doaj   +1 more source

Recent Advances in the Reactions of Cyclic Carbynes

open access: yesMolecules, 2020
The acyclic organic alkynes and carbyne bonds exhibit linear shapes. Metallabenzynes and metallapentalynes are six- or five-membered metallacycles containing carbynes, whose carbine-carbon bond angles are less than 180°.
Qian Su   +7 more
doaj   +1 more source

Characterization of the Structure of Saudi Crude Asphaltenes by X-ray Diffraction [PDF]

open access: yes, 1997
Structural characterization studies have been carried out on four commercial Saudi Arabian crude oils. The aromaticity and crystallite parameters of the asphaltenes were studied by X-ray diffraction methods and compared to the average structural ...
Ali, Mohammad F.   +2 more
core   +4 more sources

Supramolecular aromaticity

open access: yesJournal of Molecular Structure, 2014
We report experimental and theoretical evidences for supramolecular aromaticity as a new concept to be widely used in researches about molecular crystals. CSD survey regarding frequently encountered resonance-assisted H-bonds (RAHBs) in formic acid, formamide, formimidamide, formic acid-formamide, and formamide-formimidamide dimers shows that ...
Karabiyik, Hande   +2 more
openaire   +3 more sources

Influence of production variables and starting material on charcoal stable isotopic and molecular characteristics [PDF]

open access: yes, 2008
We present a systematic study on the effect of starting species, gas composition, temperature, particle size and duration of heating upon the molecular and stable isotope composition of high density (mangrove) and low density (pine) wood.
Alemany   +76 more
core   +1 more source

Aromaticidade: evolução histórica do conceito e critérios quantitativos Aromaticity: historical evolution of the concept and quantitative criteria

open access: yesQuímica Nova, 2009
In this paper the evolution of the concept of aromaticity is discussed. It considers not only historical aspects of the aromaticity concept but also the different criteria (theoretical and experimental) that have appeared to explain the properties of the
Giovanni Finoto Caramori   +1 more
doaj   +1 more source

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