Title of article :
The diatropic (sigma) ring currents of [(pi)2s+(pi)2s+(pi)2s] pericyclic transition states
Author/Authors :
Jenneskens، Leonardus W. نويسنده , , Havenith، Remco W. A. نويسنده , , Fowler، Patrick W. نويسنده , , Steiner، Erich نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2003
Pages :
-747
From page :
748
To page :
0
Abstract :
Ab initio current-density maps for the (4n+ 2)-electron transition states of two thermally allowed [(pi)2s+(pi)2s+(pi)2s] trimerisations, of ethyne to benzene (1), and of ethene to cyclohexane (2), show that both support (sigma) diatropic ring currents, dominated by four-electron (sigma) -(sigma) * virtual excitation of HOMO electrons.
Keywords :
second order Dehn function , combing , asynchronously automatic group
Journal title :
CHEMICAL COMMUNICATIONS - LETCHWORTH
Serial Year :
2003
Journal title :
CHEMICAL COMMUNICATIONS - LETCHWORTH
Record number :
69685
Link To Document :
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