Literature DB >> 34260810

Molecular electrostatic potential and noncovalent interactions in derivatives of group 8 elements.

Giuseppe Resnati1, Andrea Daolio2, Andrea Pizzi2, Miriam Calabrese2, Giancarlo Terraneo2, Simone Bordignon3, Antonio Frontera4.   

Abstract

this communication reports experimental and theoretical evidences of σ-hole interactions in adducts between nitrogen or oxygen nucleophiles and tetroxides of osmium or other group 8 elements. Cocrystals between pyridine or pyridine N-oxide derivatives and osmium tetroxide are characterized through various techniques and rationalized as σ-hole interactions using DFT calculations and several other computational tools. We propose the term "osme bond" (OmB, Om=Os, Ru, Fe) for naming the noncovalent interactions wherein group 8 elements have the role of the electrophile. The word osme is the transcription of ὀσμή, the ancient Greek word for smell that was used to name the heaviest group 8 element in relation to the smoky odor of its tetroxide.
© 2021 Wiley-VCH GmbH.

Entities:  

Keywords:  Adduct; Noncovalent interactions; Transition Metal; group 8 elements; sigma-hole

Year:  2021        PMID: 34260810     DOI: 10.1002/anie.202107978

Source DB:  PubMed          Journal:  Angew Chem Int Ed Engl        ISSN: 1433-7851            Impact factor:   15.336


  6 in total

Review 1.  Metal Coordination Enhances Chalcogen Bonds: CSD Survey and Theoretical Calculations.

Authors:  Antonio Frontera; Antonio Bauza
Journal:  Int J Mol Sci       Date:  2022-04-10       Impact factor: 6.208

Review 2.  On the Importance of Pnictogen and Chalcogen Bonding Interactions in Supramolecular Catalysis.

Authors:  Antonio Frontera; Antonio Bauza
Journal:  Int J Mol Sci       Date:  2021-11-21       Impact factor: 5.923

3.  Meta-Hybrid Density Functional Theory Prediction of the Reactivity, Stability, and IGM of Azepane, Oxepane, Thiepane, and Halogenated Cycloheptane.

Authors:  Tomsmith O Unimuke; Hitler Louis; Ededet A Eno; Ernest C Agwamba; Adedapo S Adeyinka
Journal:  ACS Omega       Date:  2022-04-15

Review 4.  Stereoselective Processes Based on σ-Hole Interactions.

Authors:  Paola Peluso; Victor Mamane
Journal:  Molecules       Date:  2022-07-20       Impact factor: 4.927

5.  Noncovalent Interactions Involving Group 6 in Biological Systems: The Case of Molybdopterin and Tungstopterin Cofactors.

Authors:  Antonio Bauzá; Antonio Frontera
Journal:  Chemistry       Date:  2022-07-13       Impact factor: 5.020

6.  Matere Bonds vs. Multivalent Halogen and Chalcogen Bonds: Three Case Studies.

Authors:  Rosa M Gomila; Antonio Frontera
Journal:  Molecules       Date:  2022-10-05       Impact factor: 4.927

  6 in total

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