IUPAC Recommendations: (Un)equivocal Understanding of Hydrogen and Halogen Bonds and Their (Un)equivocal Naming!

This manuscript shows that Si-H hydrogen acts as a donor of electron density to halogen atoms in Me3Si-H···Y complexes (Y = CF3I, BrCN), thus proving that, consistent with IUPAC definitions of hydrogen and halogen bonds, hydridic hydrogen functions as a halogen bond acceptor. This has been necessitated by a paper recently published asking whether the definition of hydrogen bonding should be revised to include hydridic H atoms acting as electron donors. We discuss the various nomenclatures used for referring to intermolecular/noncovalent bonds formed by various elements and point out the convention established in naming them by IUPAC, after long deliberations among the chemists from all over the world.

Authors

Institutions

Publication Details

Journal
Crystal Growth & Design
Published
2024-09-26
DOI
https://doi.org/10.1021/acs.cgd.4c00982
Citations
5
Primary Topic
Crystallography and molecular interactions
Type
article
Field-Weighted Citation Impact
2.22
Controls
|||
ALL TIME
JAN
FEB
MAR
APR
MAY
JUN
JUL
AUG
SEP
OCT
article

IUPAC Recommendations: (Un)equivocal Understanding of Hydrogen and Halogen Bonds and Their (Un)equivocal Naming!

Giuseppe Resnati, Pierangelo Metrangolo, E. Arunan, Steve Scheiner
5 citations
Crystal Growth & Design
Crystallography and molecular interactions
2.22
article

IUPAC Recommendations: (Un)equivocal Understanding of Hydrogen and Halogen Bonds and Their (Un)equivocal Naming!

Giuseppe Resnati, Pierangelo Metrangolo, E. Arunan, Steve Scheiner
article en
5 citations

Abstract

This manuscript shows that Si-H hydrogen acts as a donor of electron density to halogen atoms in Me3Si-H···Y complexes (Y = CF3I, BrCN), thus proving that, consistent with IUPAC definitions of hydrogen and halogen bonds, hydridic hydrogen functions as a halogen bond acceptor. This has been necessitated by a paper recently published asking whether the definition of hydrogen bonding should be revised to include hydridic H atoms acting as electron donors. We discuss the various nomenclatures used for referring to intermolecular/noncovalent bonds formed by various elements and point out the convention established in naming them by IUPAC, after long deliberations among the chemists from all over the world.

Crystal Growth & Design
Utah State University (US), Indian Institute of Science Bangalore (IN), Politecnico di Milano (IT)
Openalex Percentile: Top 10%
Crystallography and molecular interactions
2.22
AI Navigator

Ask Laika to Summarize, Analyze, and Connect papers live on the map.

Summarize Papers & Methodologies

Extract key findings, datasets, and comparative methods across publications.

Benchmark Rankings & Visual Analytics

Rank top research institutions, authors, funders, topics, and journals by Field-Weighted Citation Impact (FWCI) and paper volume with instant charts.

Connect Distant Disciplines

Bridge topological clusters on the map to find hidden collaborative intersections.