A theoretical approach to the regioselectivity in 1,3-dipolar cycloadditions of diazoalkanes, hydrazoic acid and nitrous oxide to acetylenes, phosphaalkynes and cyanides

Journal of Physical Organic Chemistry

Volumn 16, Issue 9, 2003, Pages 615-625

  Nguyen, Loc Thanh ^a,b,c   De Proft, Frank ^b   Dao, Van Luong ^a   Nguyen, Minh Tho ^c   Geerlings, Paul ^b  

^a Ho Chi Minh City University of Technology   (Viet Nam)

^b VRIJE UNIVERSITEIT BRUSSEL   (Belgium)

^c UNIVERSITY OF LEUVEN   (Belgium)

Author keywords

1,3 dipolar cycloadditions; Density functional theory; Hard and soft acids and bases; Local softness; Regioselectivity

Indexed keywords

ACETYLENE; CYANIDES; PROBABILITY DENSITY FUNCTION;

REGIOSELECTIVITY;

PARAFFINS;

EID: 0042364952     PISSN: 08943230     EISSN: None     Source Type: Journal    
DOI: 10.1002/poc.653     Document Type: Article

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