A SOPPA theoretical study of the spin-spin coupling constants of all fluorobenzenes C6HnF6-n (n = 0-5)

Journal of Molecular Structure

Volumn 964, Issue 1-3, 2010, Pages 119-125

  Alkorta, Ibon ^a   Blanco, Fernando ^a   Elguero, José ^a  

^a INSTITUTO DE QUÍMICA MÉDICA   (Spain)

Author keywords

Coupling constants; Fluorobenzenes; MP2 aug cc pVTZ; NMR; SOPPA

Indexed keywords

COUPLING CONSTANTS; SECOND ORDERS; SPIN-SPIN COUPLING CONSTANTS; THEORETICAL STUDY;

NUCLEAR MAGNETIC RESONANCE;

SPIN DYNAMICS;

EID: 73749085842     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molstruc.2009.11.019     Document Type: Article

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