Core-electron contributions to the magnetic response of molecules with heavy elements and their significance in aromaticity assessments
This study delves into the magnetic response of core electrons and their influence on the
global magnetic response of planar and three-dimensional systems containing heavy …
global magnetic response of planar and three-dimensional systems containing heavy …
D 4h H© K 4 H 4−: A planar tetracoordinate hydrogen global minimum
LX Bai, YX **, JC Guo - Chemical Communications, 2024 - pubs.rsc.org
Herein we report a square-like D4h H© K4H4− anion with one planar tetracoordinate
hydrogen (ptH) center, which is the global minimum (GM) structure and possesses good …
hydrogen (ptH) center, which is the global minimum (GM) structure and possesses good …
Alkali Metal Decorated Planar Tetracoordinate Hydrogen
Despite the long list of planar tetracoordinate atoms, hydrogen is elusive. This is especially
due to the inherent ability of hydrogen to form multicenter bonds with other centers. Herein …
due to the inherent ability of hydrogen to form multicenter bonds with other centers. Herein …
InnTl4–nH+ (n = 0∼4): Tetracoordinate Hydrogen in a Planar Fashion?
L Cui, X Liu, H Zhang, B Yan, M Orozco-Ic… - Inorganic …, 2024 - ACS Publications
The recent report of planar tetracoordinate hydrogen (ptH) in In4H+ is very intriguing in
planar hypercoordinate chemistry. Our high-level CCSD (T) calculations revealed that the …
planar hypercoordinate chemistry. Our high-level CCSD (T) calculations revealed that the …
[HTML][HTML] Cl©Li5Cl5−: A Star-like Superhalogen Anion Featuring a Planar Pentacoordinate Chlorine at the Center
LX Bai, CY Gao, JC Guo, SD Li - Molecules, 2024 - mdpi.com
Among the known planar pentacoordinate atoms, chlorine is missing due to its large radius
and high electronegativity. Herein, we report the first star-like superhalogen anion D 5 h Cl© …
and high electronegativity. Herein, we report the first star-like superhalogen anion D 5 h Cl© …
FK4H4–: Planar Tetracoordinate Fluorine Stabilized by Multicenter Ionic Bonding
YX **, LX Bai, JC Guo - Inorganic Chemistry, 2024 - ACS Publications
Planar tetracoordinate fluorine (ptF) species are very exotic and scarce due to high
electronegativity of fluorine. Herein we report the ternary square ptF cluster, D 4 h FK4H4 …
electronegativity of fluorine. Herein we report the ternary square ptF cluster, D 4 h FK4H4 …
Planar Pentacoordinate Halogens
Planar hypercoordinate motifs represent an intriguing frontier in chemistry, challenging
traditional bonding norms. As electronegativity of the central atom increases, achieving …
traditional bonding norms. As electronegativity of the central atom increases, achieving …
D 5h H© Cu 5 H 5−: a covalently bonded planar pentacoordinate hydrogen star
A D5h hydrocopper H© Cu5H5− star with planar pentacoordinate hydrogen (ppH) was
designed. This structure is the global minimum, exhibiting dynamic stability. Its planar …
designed. This structure is the global minimum, exhibiting dynamic stability. Its planar …
Revisiting the Structure and Bonding in Li5H6– and the Exploration of Reactivity: Planar Pentacoordinate Hydrogen
Recently, Guha and co-workers (Sarmah, K.; Kalita, A.; Purkayastha, S.; Guha, AK Pushing
The Extreme of Multicentre Bonding: Planar Pentacoordinate Hydride. Angew. Chem. Int …
The Extreme of Multicentre Bonding: Planar Pentacoordinate Hydride. Angew. Chem. Int …
Enhancing Precatalyst Performance and Robustness through Aromaticity: Insights from Iridaheteroaromatics
Despite the inherent stability-enhancing benefits of dπ–pπ conjugation-induced aromaticity,
metallaaromatic catalysts remain underutilized in this context, despite their reactivity with …
metallaaromatic catalysts remain underutilized in this context, despite their reactivity with …