The bright future of unconventional σ/π‐hole interactions

A Bauzá, TJ Mooibroek, A Frontera - ChemPhysChem, 2015 - Wiley Online Library
Non‐covalent interactions play a crucial role in (supramolecular) chemistry and much of
biology. Supramolecular forces can indeed determine the structure and function of a host …

Tetrel bonding interactions at work: Impact on tin and lead coordination compounds

A Bauzá, SK Seth, A Frontera - Coordination Chemistry Reviews, 2019 - Elsevier
A tetrel bond can be defined as an interaction between any electron donating moiety and a
group 14 element acting as Lewis acid. Experimental and theoretical research on this …

From weak to strong interactions: A comprehensive analysis of the topological and energetic properties of the electron density distribution involving systems

E Espinosa, I Alkorta, J Elguero… - The Journal of chemical …, 2002 - pubs.aip.org
The topological and energetic properties of the electron density distribution ρ (r) of the
isolated pairwise H⋯ F interaction have been theoretically calculated at several geometries …

Tetrel bonding interactions

A Bauzá, TJ Mooibroek, A Frontera - The Chemical Record, 2016 - Wiley Online Library
Tetrel (Tr) bonding is first placed into perspective as a σ‐hole bonding interaction with atoms
of the Tr family. An sp3 R4Tr unit has four σ‐holes with which a Lewis base can form a …

On the importance of σ–hole interactions in crystal structures

A Frontera, A Bauzá - Crystals, 2021 - mdpi.com
Elements from groups 14–18 and periods 3–6 commonly behave as Lewis acids, which are
involved in directional noncovalent interactions (NCI) with electron-rich species (lone pair …

On the importance of pnictogen and chalcogen bonding interactions in supramolecular catalysis

A Frontera, A Bauza - International Journal of Molecular Sciences, 2021 - mdpi.com
In this review, several examples of the application of pnictogen (Pn)(group 15) and
chalcogen (Ch) bonding (group 16) interactions in organocatalytic processes are gathered …

Systematic elucidation of factors that influence the strength of tetrel bonds

S Scheiner - The Journal of Physical Chemistry A, 2017 - ACS Publications
Quantum calculations are used to examine the properties of heterodimers formed by a
series of tetrel-containing molecules with NH3 as universal Lewis base. TH4 was taken as a …

CHAL336 benchmark set: How well do quantum-chemical methods describe chalcogen-bonding interactions?

N Mehta, T Fellowes, JM White… - Journal of Chemical …, 2021 - ACS Publications
We present the CHAL336 benchmark set—the most comprehensive database for the
assessment of chalcogen-bonding (CB) interactions. After careful selection of suitable …

Triel bond and coordination of triel centres–Comparison with hydrogen bond interaction

SJ Grabowski - Coordination Chemistry Reviews, 2020 - Elsevier
The triel bond may be defined as the interaction of the atom of 13th group that acts as the
Lewis acid centre with the electron rich site of the species playing a role of the Lewis base …

[HTML][HTML] Understanding noncovalent bonds and their controlling forces

S Scheiner - The Journal of Chemical Physics, 2020 - pubs.aip.org
The fundamental underpinnings of noncovalent bonds are presented, focusing on the σ-hole
interactions that are closely related to the H-bond. Different means of assessing their …