Article ID Journal Published Year Pages File Type
1410164 Journal of Molecular Structure 2010 7 Pages PDF
Abstract

The 295 experimental spin–spin coupling constants (SSCC) determined for fluorobenzenes were compared with the calculated ones using the second-order polarization propagator approximation (SOPPA). The agreement is, on the whole, good and the discrepancies were analyzed comparing couplings of the same class of coupling families.

Related Topics
Physical Sciences and Engineering Chemistry Organic Chemistry
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