Natural J coupling (NJC) analysis of the electron lone pair effect on NMR couplings: Part 1. the lone pair orientation effect of an α-nitrogen atom on1J(C,C) couplings

Magnetic Resonance in Chemistry

Volumn 39, Issue 10, 2001, Pages 600-606

  Barone, Verónica ^a,b   Peralta, Juan E ^a,b   Contreras, Rubén H ^a,b   Sosnin, Anton V ^a,b   Krivdin, Leonid B ^a,b  

^a UNIVERSIDAD DE BUENOS AIRES   (Argentina)

^b ANGARSK STATE TECHNICAL UNIVERSITY   (Russian Federation)

Author keywords

Bond contributions; Indirect spin spin couplings; Lone pair effect; Natural j couplings; Nbo interactions; NMR

Indexed keywords

ATOMS; CARBON; COUPLINGS; DISSECTION; NITROGEN;

BOND CONTRIBUTION; C-C COUPLING; INDIRECT SPIN-SPIN COUPLING; J COUPLING; LONE PAIR; LONE-PAIR EFFECTS; NATURAL J COUPLING; NBO INTERACTION; NITROGEN ATOM; ORIENTATION EFFECT;

ACETONE;

EID: 0142078714     PISSN: 07491581     EISSN: None     Source Type: Journal    
DOI: 10.1002/mrc.901     Document Type: Article

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