Experimental and DFT studies on the transmission mechanisms of analogous NMR JCH and JCC couplings in 1-X- and 1-X-3- methylbicyclo[1.1.1]-pentanes

Magnetic Resonance in Chemistry

Volumn 45, Issue 7, 2007, Pages 572-577

  Contreras, Rubén H ^a   Esteban, Ángel L ^b   Díez, Ernesto ^c   Lochert, Ian J ^d   Della, Ernest W ^d   Tormena, Cláudio F ^e  

^a UNIVERSIDAD DE BUENOS AIRES   (Argentina)

^b UNIVERSITY OF ALICANTE   (Spain)

^c UNIVERSIDAD AUTÓNOMA DE MADRID   (Spain)

^d FLINDERS UNIVERSITY   (Australia)

^e UNIVERSITY OF CAMPINAS   (Brazil)

Author keywords

Bicyclo 1.1.1 pentanes; Coupling pathways; Hyperconjugative interactions; Spin spin couplings; Strain effect

Indexed keywords

PARAFFINS;

BICYCLO[1.1.1]-PENTANE; COUPLING PATHWAY; DFT STUDY; ELECTRON DELOCALIZATION; FERMI CONTACT TERM; GAIN INSIGHT; HYPERCONJUGATIVE INTERACTIONS; SPIN-SPIN COUPLINGS; STRAIN EFFECT; TRANSMISSION MECHANISMS;

COUPLINGS;

EID: 34250737349     PISSN: 07491581     EISSN: 1097458X     Source Type: Journal    
DOI: 10.1002/mrc.2009     Document Type: Article

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