Ab Initio Based Exploration of the Potential Energy Surface for the Double Proton Transfer in the First Excited Singlet Electronic State of the 7-Azaindole Dimer-Reference-Cited by-同舟云学术

Ab Initio Based Exploration of the Potential Energy Surface for the Double Proton Transfer in the First Excited Singlet Electronic State of the 7-Azaindole Dimer

Published:2001-03-23 Issue:15 Volume:105 Page:3887-3893
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Moreno Miguel¹,Douhal Abderrazzak¹,Lluch José M.¹,Castaño Obis¹,Frutos Luis M.¹

Affiliation:

1. Unitat de Química Física, Departament de Química, Universitat Autònoma de Barcelona, 08193 Bellaterra, Barcelona, Spain, Departamento de Química Física, Facultad de Ciencias del Medio Ambiente, Avenida Carlos III, SN, Campus Tecnológico de Toledo, Universidad de Castilla-La Mancha, 45071 Toledo, Spain, and Departamento de Química Física, Universidad de Alcalá, 28871 Alcalá de Henares, Madrid, Spain

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp003797p

Reference61 articles.

1. Proton-transfer reaction dynamics

2. EXCITED-STATE TWO-PROTON TAUTOMERISM IN HYDROGEN-BONDED N-HETEROCYCLIC BASE PAIRS

3. Confirmation of biprotonic phototautomerism in 7-azaindole hydrogen-bonded dimers

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