Resonance‐assisted hydrogen bonding as a driving force in synthesis and a synthon in the design of materials

KT Mahmudov, AJL Pombeiro - Chemistry–A European …, 2016 - Wiley Online Library
Resonance‐assisted hydrogen bonding (RAHB), a concept introduced by Gilli and co‐
workers in 1989, concerns a kind of intramolecular H‐bonding strengthened by a …

[HTML][HTML] Intramolecular hydrogen bonds in selected aromatic compounds: Recent developments

A Jezierska, PM Tolstoy, JJ Panek, A Filarowski - Catalysts, 2019 - mdpi.com
A review of intramolecular hydrogen bonding in ortho-hydroxyaryl Schiff bases, ortho-
hydroxyaryl Mannich bases, dipyrrins, ortho-hydroxyaryl ketones, ortho-hydroxyaryl amides …

The π‐Tetrel Bond and its Influence on Hydrogen Bonding and Proton Transfer

Y Wei, Q Li, S Scheiner - ChemPhysChem, 2018 - Wiley Online Library
The positive region that lies above the plane of F2TO (T= C and Si) interacts with
malondialdehyde (MDA), which contains an intramolecular H‐bond. The T atom of F2TO can …

Intramolecular O–H··· O C Hydrogen Bond Energy via the Molecular Tailoring Approach to RAHB Structures

D Rusinska-Roszak - The Journal of Physical Chemistry A, 2015 - ACS Publications
A method for the calculation of the intramolecular hydrogen bond (HB) energy (E HB) by
molecular tailoring approach for hydroxycarbonyl aliphatic compounds has been used for …

Resonance-assisted hydrogen bond—revisiting the original concept in the context of its criticism in the literature

M Domagała, S Simon, M Palusiak - International Journal of Molecular …, 2021 - mdpi.com
In the presented research, we address the original concept of resonance-assisted hydrogen
bonding (RAHB) by means of the many-body interaction approach and electron density …

Evaluation of electron density shifts in noncovalent interactions

I Iribarren, G Sánchez-Sanz, I Alkorta… - The Journal of …, 2021 - ACS Publications
In the present paper, we report the quantitative evaluation of the electron density shift (EDS)
maps within different complexes. Values associated with the total EDS maps exhibited good …

Estimation of the Intramolecular O–H··· O C Hydrogen Bond Energy via the Molecular Tailoring Approach. Part I: Aliphatic Structures

D Rusinska-Roszak, G Sowinski - Journal of Chemical Information …, 2014 - ACS Publications
A simple and universal method for the estimation of the intramolecular hydrogen bond (HB)
energy (E HB) in hydroxycarbonyl aliphatic compounds is proposed by the application of the …

Intramolecular Hydrogen Bond in Biologically Active o-Carbonyl Hydroquinones

M Martínez-Cifuentes, BE Weiss-López, LS Santos… - Molecules, 2014 - mdpi.com
Intramolecular hydrogen bonds (IHBs) play a central role in the molecular structure,
chemical reactivity and interactions of biologically active molecules. Here, we study the IHBs …

Cooperative and anticooperative effects in resonance assisted hydrogen bonds in merged structures of malondialdehyde

E Romero-Montalvo, JM Guevara-Vela… - Physical Chemistry …, 2017 - pubs.rsc.org
We analyzed non-additive effects in resonance assisted hydrogen bonds (RAHBs) in
different β-enolones, which are archetypal compounds of these types of interactions. For this …

Halogen bonds in clathrate cages: A real space perspective

JM Guevara‐Vela, D Ochoa‐Resendiz… - …, 2018 - Wiley Online Library
In this paper we present real space analyses of the nature of the dihalogen‐water cage
interactions in the 512 and 51262 clathrate cages containing chlorine and bromine …