Transmission of spin-spin coupling constants through different paths in bicyclo(2,2,1)heptane: their calculation using inner projections of the polarization propagator
Publication
, Journal Article
Scuseria, GE; Facelli, JC; Contreras, RH; Engelmann, AR
Published in: Chemical Physics Letters
April 22, 1983
Inner projections of the polarization propagator are used to calculate components of the Fermi contact interaction between protons attached to the bridgehead carbon atoms of bicyclo(2,2,1)Heptane. Four- and five-bond paths and throuh-space interaction are considered. Reasonable path additivity and agreement with experimental data are found at the INDO level. © 1983.
Duke Scholars
Published In
Chemical Physics Letters
DOI
ISSN
0009-2614
Publication Date
April 22, 1983
Volume
96
Issue
5
Start / End Page
560 / 562
Related Subject Headings
- Chemical Physics
- 51 Physical sciences
- 34 Chemical sciences
- 10 Technology
- 03 Chemical Sciences
- 02 Physical Sciences
Citation
APA
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Scuseria, G. E., Facelli, J. C., Contreras, R. H., & Engelmann, A. R. (1983). Transmission of spin-spin coupling constants through different paths in bicyclo(2,2,1)heptane: their calculation using inner projections of the polarization propagator. Chemical Physics Letters, 96(5), 560–562. https://doi.org/10.1016/0009-2614(83)80448-5
Scuseria, G. E., J. C. Facelli, R. H. Contreras, and A. R. Engelmann. “Transmission of spin-spin coupling constants through different paths in bicyclo(2,2,1)heptane: their calculation using inner projections of the polarization propagator.” Chemical Physics Letters 96, no. 5 (April 22, 1983): 560–62. https://doi.org/10.1016/0009-2614(83)80448-5.
Scuseria GE, Facelli JC, Contreras RH, Engelmann AR. Transmission of spin-spin coupling constants through different paths in bicyclo(2,2,1)heptane: their calculation using inner projections of the polarization propagator. Chemical Physics Letters. 1983 Apr 22;96(5):560–2.
Scuseria, G. E., et al. “Transmission of spin-spin coupling constants through different paths in bicyclo(2,2,1)heptane: their calculation using inner projections of the polarization propagator.” Chemical Physics Letters, vol. 96, no. 5, Apr. 1983, pp. 560–62. Scopus, doi:10.1016/0009-2614(83)80448-5.
Scuseria GE, Facelli JC, Contreras RH, Engelmann AR. Transmission of spin-spin coupling constants through different paths in bicyclo(2,2,1)heptane: their calculation using inner projections of the polarization propagator. Chemical Physics Letters. 1983 Apr 22;96(5):560–562.
Published In
Chemical Physics Letters
DOI
ISSN
0009-2614
Publication Date
April 22, 1983
Volume
96
Issue
5
Start / End Page
560 / 562
Related Subject Headings
- Chemical Physics
- 51 Physical sciences
- 34 Chemical sciences
- 10 Technology
- 03 Chemical Sciences
- 02 Physical Sciences