DFT investigation of nitrenium ions derived from metabolism of antitumor 2-(4-aminophenyl)benzothiazoles

Journal of Molecular Structure: THEOCHEM

Volumn 731, Issue 1-3, 2005, Pages 115-121

  Hilal, Rifaat ^a   Khalek, Ahmed A Abdel ^a   Elroby, Shabaan A K ^a  

^a CAIRO UNIVERSITY   (Egypt)

Author keywords

Antitumor 2 (4 aminophenyl)benzothiazole; Nitrenium ions; PCM and internal rotation; S T gap

Indexed keywords

EID: 26044481689     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2005.04.017     Document Type: Article

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