Origins and properties of the tetrel bond

S Scheiner - Physical Chemistry Chemical Physics, 2021 - pubs.rsc.org
The tetrel bond (TB) recruits an element drawn from the C, Si, Ge, Sn, Pb family as electron
acceptor in an interaction with a partner Lewis base. The underlying principles that explain …

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 …

Comparative strengths of tetrel, pnicogen, chalcogen, and halogen bonds and contributing factors

W Dong, Q Li, S Scheiner - Molecules, 2018 - mdpi.com
Ab initio calculations are employed to assess the relative strengths of various noncovalent
bonds. Tetrel, pnicogen, chalcogen, and halogen atoms are represented by third-row atoms …

Halogen, chalcogen, and pnicogen bonding involving hypervalent atoms

S Scheiner, J Lu - Chemistry–A European Journal, 2018 - Wiley Online Library
The additional substituents arising from hypervalency present a number of complicating
issues for the formation of noncovalent bonds. The XF5 molecule (X= Cl, Br, I) was allowed …

Implications of monomer deformation for tetrel and pnicogen bonds

W Zierkiewicz, M Michalczyk, S Scheiner - … Chemistry Chemical Physics, 2018 - pubs.rsc.org
A series of TF4 and ZF5 molecules (T= Si, Ge, Sn and Z= P, As, Sb) were allowed to engage
in tetrel and pnicogen bonds, respectively, with NH3, pyrazine, and HCN. The interaction …

The ditetrel bond: noncovalent bond between neutral tetrel atoms

S Scheiner - Physical Chemistry Chemical Physics, 2020 - pubs.rsc.org
The ability of a tetrel atom to serve in the capacity of electron donor in a σ-hole noncovalent
bond is tested by quantum calculations. The donor molecule TMH3 contains a metal atom M …

From 'halogen'to 'tetrel'bonds: matrix isolation IR spectroscopic and quantum mechanical studies of the effect of central atom substitution in donor tetrahalogens on …

I Bhattacharya, P Banerjee - Physical Chemistry Chemical Physics, 2024 - pubs.rsc.org
Binary complex formation between silicon tetrachloride (SiCl4) and formic acid (FA) has
been observed in an argon matrix environment. Such complex formation manifests as …

Steric crowding in tetrel bonds

S Scheiner - The Journal of Physical Chemistry A, 2018 - ACS Publications
The tetravalent character of tetrel atoms leaves only limited room for an incoming
nucleophile to approach and engage in a noncovalent bond with a tetrel atom. Any such …

Unexpected chalcogen bonds in tetravalent sulfur compounds

A Franconetti, D Quiñonero, A Frontera… - Physical Chemistry …, 2019 - pubs.rsc.org
In this manuscript we have combined a CSD (Cambridge Structural Database) analysis with
theoretical calculations (RI-MP2/def2-TZVP level of theory) to study the importance of …

Assembly of effective halide receptors from components. Comparing hydrogen, halogen, and tetrel bonds

S Scheiner - The Journal of Physical Chemistry A, 2017 - ACS Publications
Receptors for halide anions are constructed based on the imidazolium unit and then
replacing the H-bonding C–H group first by halogen-bonding C–I and then by tetrel-bonding …