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Analysis of the transmission mechanism of NMR spin-spin coupling constants using fermi contact spin density distribution, partial spin polarization and orbital currents: XH(sub n) molecules
- Source :
- Journal of Physical Chemistry A. Sept 11, 2003, Vol. 107 Issue 36, 7043-7056
- Publication Year :
- 2003
-
Abstract
- The fermi contact spin density contribution to the isotropic scalar spin-spin coupling constants is studied. It is demonstrated that irregularities in the trends of the measured spin-spin coupling constants (SSCC) can be explained as a simple result of electronegativity and polarizability of the central atom X.
Details
- Language :
- English
- ISSN :
- 10895639
- Volume :
- 107
- Issue :
- 36
- Database :
- Gale General OneFile
- Journal :
- Journal of Physical Chemistry A
- Publication Type :
- Academic Journal
- Accession number :
- edsgcl.123312208