Theoretical perspectives on redox "non-innocent" oxazolidine N-oxide iron nitroxide complexes

European Journal of Inorganic Chemistry

Volumn , Issue 5-6, 2013, Pages 1024-1032

  Tewary, Subrata ^a   Gass, Ian A ^b   Murray, Keith S ^b   Rajaraman, Gopalan ^a  

^a INDIAN INSTITUTE OF TECHNOLOGY BOMBAY   (India)

^b MONASH UNIVERSITY   (Australia)

Author keywords

Density functional calculations; Iron; Magnetic properties; Radicals; Spin crossover

Indexed keywords

ELECTRONIC STRUCTURE; IRON OXIDES; REDOX REACTIONS;

DENSITY-FUNCTIONAL CALCULATIONS; ELECTRONIC.STRUCTURE; MAGNETIC EXCHANGE; NITROXIDES; OXAZOLIDINES; RADICAL; RADICAL SPECIES; REDOX ACTIVE METAL CENTERS; REDOX PROCESS; SPIN CROSSOVERS;

DENSITY FUNCTIONAL THEORY;

EID: 84961982771     PISSN: 14341948     EISSN: 10990682     Source Type: Journal    
DOI: 10.1002/ejic.201201077     Document Type: Article

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