Singlet−Triplet Gap in α-n-Dehydrotoluene and Related Biradicals: An ab Initio Configuration Interaction Study-Reference-Cited by-同舟云学术

Singlet−Triplet Gap in α-n-Dehydrotoluene and Related Biradicals: An ab Initio Configuration Interaction Study

Published:1999-07-16 Issue:31 Volume:103 Page:6220-6224
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Cabrero J.¹,Ben-Amor N.¹,Caballol R.¹

Affiliation:

1. Departament de Química Física i Inorgànica, Universitat Rovira i Virgili, Pl. Imperial Tarraco, 1. 43005 Tarragona, Spain

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp990123%2B

Reference47 articles.

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2. Intramolecular coupling of two radical centers through 1,1-diphenylethylene chromophores. Isomeric dinitroxides vinylogous to trimethylenemethane, tetramethyleneethane, and pentamethylenepropane

3. Intramolecular magnetic coupling between two nitrene or two nitroxide units through 1,1-diphenylethylene chromophores. Isomeric dinitrenes and dinitroxides related in connectivity to trimethylenemethane, tetramethyleneethane, and pentamethylenepropane

4. StableN, N′-Di-tert-butyl-meta-phenylene-bisnitroxides—Unexpected Ground-State Singlets

5. Long-lived spin isomerism of singlet and triplet states of N-arenesulfonyl-3,4-dimethylenepyrroles

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