Conformational and configurational analysis of an N,N carbonyl dipyrrinone-derived oximate and nitrone by NMR and quantum chemical calculations

Magnetic Resonance in Chemistry

Volumn 49, Issue 5, 2011, Pages 205-212

  Walton, Ian ^a   Davis, Marauo ^b   Yang, Liu ^b   Zhang, Yong ^b,c   Tillman, Destin ^a   Jarrett, William L ^d   Huggins, Michael T ^a,b   Wallace, Karl J ^a,b  

^a UNIVERSITY OF WEST FLORIDA   (United States)

^b The University of Southern Mississippi   (United States)

^c Stevens Institute of Technology   (United States)

^d Virginia Polytechnic Institute and State University   (United States)

Author keywords

configurational isomers; DFT calculations; nitrone; NMR; oxime; spin spin coupling constants

Indexed keywords

ATOMS; ISOMERS; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; QUANTUM CHEMISTRY;

CONFIGURATIONAL ISOMERS; DFT CALCULATION; DIPYRRINONES; N-CARBONYL; NITRONES; OXIME; QUANTUM CHEMICAL CALCULATIONS; QUANTUM-CHEMICAL CALCULATION; RELATIVE ENERGIES; SPIN-SPIN COUPLING CONSTANTS;

CONFORMATIONS;

EID: 79955049248     PISSN: 07491581     EISSN: 1097458X     Source Type: Journal    
DOI: 10.1002/mrc.2728     Document Type: Article

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