σ-Hole⋯π and lone pair⋯π interactions in benzylic halides

Author:

Montoro Teresa123,Tardajos Gloria45673,Guerrero Andrés45673,Torres María del Rosario85673,Salgado Cástor91073,Fernández Israel91073,Osío Barcina José91073

Affiliation:

1. EUIT Forestales

2. Universidad Politécnica de Madrid

3. Spain

4. Departamento de Química Física

5. Facultad de Ciencias Químicas

6. Universidad Complutense de Madrid

7. 28040 Madrid

8. Laboratorio de difracción de Rayos X

9. Departamento de Química Orgánica

10. Facultad de Ciencias Químicas. Universidad Complutense de Madrid

Abstract

Depending on the relative orientation of the halogen atom and the phenyl ring, the benzylic halides studied show “classical” halogen⋯π bonds as well as intramolecular interactions without σ-hole participation based on n → π* (LP⋯π) interactions.

Publisher

Royal Society of Chemistry (RSC)

Subject

Organic Chemistry,Physical and Theoretical Chemistry,Biochemistry

Reference101 articles.

1. Halogen Bonding: Fundamentals and Applications, of Structure and Bonding, Vol. 126, ed. P. Metrangolo and G. Resnati, Springer, Berlin, 2008

2. Halogen Bonding in Supramolecular Chemistry

3. Halogen Bonding: Where We Are and Where We Are Going

4. Halogen bonding: an electrostatically-driven highly directional noncovalent interaction

5. Halogen Bonding: An Interim Discussion

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