The ground and ionic states of cyclohepta-1,3,5-triene and their relationship to norcaradiene states: New


Journal

The Journal of chemical physics
ISSN: 1089-7690
Titre abrégé: J Chem Phys
Pays: United States
ID NLM: 0375360

Informations de publication

Date de publication:
14 Apr 2020
Historique:
entrez: 17 4 2020
pubmed: 17 4 2020
medline: 17 4 2020
Statut: ppublish

Résumé

The strong inter-relationship between cyclohepta-1,3,5-triene (CHT) and norcaradiene (NCD) systems observed in some reactions has been extended to include the energy surfaces for some low-lying ionic states. Equilibrium structures for ionic states of CHT with

Identifiants

pubmed: 32295354
doi: 10.1063/1.5142268
doi:

Types de publication

Journal Article

Langues

eng

Sous-ensembles de citation

IM

Pagination

144301

Auteurs

Michael H Palmer (MH)

School of Chemistry, University of Edinburgh, Joseph Black Building, David Brewster Road, Edinburgh EH9 3FJ, Scotland, United Kingdom.

R Alan Aitken (RA)

School of Chemistry, University of St Andrews, North Haugh, St Andrews Fife, St Andrews KY16 9ST, Scotland, United Kingdom.

Marcello Coreno (M)

ISM-CNR, Istituto di Struttura della Materia, LD2 Unit, 34149 Trieste, Italy.

Monica de Simone (M)

IOM-CNR Laboratorio TASC, Trieste, Italy.

Cesare Grazioli (C)

IOM-CNR Laboratorio TASC, Trieste, Italy.

Søren Vrønning Hoffmann (SV)

ISA, Department of Physics and Astronomy, Aarhus University, Ny Munkegade 120, DK-8000 Aarhus C, Denmark.

Nykola C Jones (NC)

ISA, Department of Physics and Astronomy, Aarhus University, Ny Munkegade 120, DK-8000 Aarhus C, Denmark.

Classifications MeSH