Four decades of the chemistry of planar hypercoordinate compounds

LM Yang, E Ganz, Z Chen, ZX Wang… - Angewandte Chemie …, 2015 - Wiley Online Library
The idea of planar tetracoordinate carbon (ptC) was considered implausible for a hundred
years after 1874. Examples of ptC were then predicted computationally and realized …

Planar pentacoordinate carbons

V Vassilev-Galindo, S Pan, KJ Donald… - Nature Reviews …, 2018 - nature.com
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 …

AlxC Monolayer Sheets: Two-Dimensional Networks with Planar Tetracoordinate Carbon and Potential Applications as Donor Materials in Solar Cell

J Dai, X Wu, J Yang, XC Zeng - The journal of physical chemistry …, 2014 - ACS Publications
We perform a global search of the most stable structures of 2D stoichiometric Al x C (x= 1/3,
1, 2, and 3) monolayer sheets. In the most stable 2D planar AlC network, every carbon atom …

Planar pentacoordinate carbon in a sulphur-surrounded boron wheel: The global minimum of CB 5 S 5+

R Sun, B Jin, B Huo, C Yuan, HJ Zhai… - Chemical …, 2022 - pubs.rsc.org
We report a σ+ π double aromatic CB5S5+ cluster, the first global minimum unusually
having a planar hypercoordinate carbon inside a boron wheel. Five peripheral sulfur atoms …

Structural Evolution of Carbon-Doped Aluminum Clusters AlnC (n = 6–15): Anion Photoelectron Spectroscopy and Theoretical Calculations

CJ Zhang, WS Dai, HG Xu, XL Xu… - The Journal of Physical …, 2022 - ACS Publications
Carbon-doped aluminum cluster anions, Al n C–(n= 6–15), were generated by laser
vaporization and investigated by mass-selected anion photoelectron spectroscopy. The …

Characterizing metal carbide structures: Insights from photoelectron spectroscopy and density functional theory

M Ali, U Farooq, XL Xu, HG Xu, WJ Zheng - Coordination Chemistry …, 2025 - Elsevier
Metal carbides are highly intriguing to researchers due to their diverse properties, including
electrical, thermal, magnetic, and mechanical characteristics. They are prized for their high …

Planar hexacoordinate gallium

M Wang, C Chen, S Pan, Z Cui - Chemical Science, 2021 - pubs.rsc.org
We report the first planar hexacoordinate gallium (phGa) center in the global minimum of the
GaBe6Au6+ cluster which has a star-like D6h geometry with 1A1g electronic state …

From Molecules with a Planar Tetracoordinate Carbon to an Astronomically Known C5H2 Carbene

A Karton, VS Thimmakondu - The Journal of Physical Chemistry A, 2022 - ACS Publications
Ethynylcyclopropenylidene (2), an isomer of C5H2, is a known molecule in the laboratory
and has recently been identified in Taurus Molecular Cloud-1 (TMC-1). Using high-level …

Photoelectron spectroscopy and theoretical study of Al n C 5−/0 (n= 1–5) clusters: structural evolution, relative stability of star-like clusters, and planar tetracoordinate …

CJ Zhang, P Wang, XL Xu, HG Xu… - Physical Chemistry …, 2021 - pubs.rsc.org
The AlnC5−(n= 1–5) clusters were detected in the gas-phase and were investigated via
mass-selected anion photoelectron spectroscopy. The structures of AlnC5−/0 (n= 1–5) were …

CSiGaAl2−/0 and CGeGaAl2−/0 having planar tetracoordinate carbon atoms in their global minimum energy structures

P Das, PK Chattaraj - Journal of Computational Chemistry, 2022 - Wiley Online Library
Density functional theory (DFT) is used to explore the structure, stability, and bonding in
CSiGaAl2−/0 and CGeGaAl2−/0 systems having planar tetracoordinate carbon (ptC). The …