Aromaticity is indispensable for explaining a variety of chemical behaviors, including reactivity, structural features, relative energetic stabilities, and spectroscopic properties …
Carbon centres in typical organic molecules have a coordination number that can reach a maximum of four, in which case the bonded atoms are situated at the vertices of a …
In this work, we used the induced magnetic field (B ind) to study the degree of aromaticity of the planar (HF) 3 ring. The induced magnetic field analysis shows that the degree of electron …
A new approach to stabilize compounds containing a planar tetracoordinate carbon (ptC), embedded in aromatic hydrocarbons, is presented herein. This is achieved by using ligands …
YB Wu, HG Lu, SD Li, ZX Wang - The Journal of Physical …, 2009 - ACS Publications
Ab initio and DFT calculations have been carried out to search for the simplest neutral singlet species with double planar tetracoordinate carbons (dptCs)[the “simplest” means the …
Recently, we reported a series of global minima whose structures consist of carbon rings decorated with heavier group 14 elements. Interestingly, these structures feature planar …
MJ Sun, X Cao, Z Cao - Nanoscale, 2018 - pubs.rsc.org
Stabilization of planar tetra-coordinate silicon (ptSi) was achieved in compounds and 2D- layered extended systems, in which single molecular ptSi in C12H8Si captures four …
A simple and chemically intuitive approach is used to design ptC-containing E–C clusters (E= Si–Pb). This approach consists in replacing three or two consecutive protons from an …
E Ravell, S Jalife, J Barroso… - Chemistry–An Asian …, 2018 - Wiley Online Library
The structure, bonding, and stability of clusters with the empirical formula CE5−(E= Al–Tl) have been analyzed by means of high‐level computations. The results indicate that …