Quantifying electron delocalization in orthogonal channels: Theoretical investigation of σ and π aromaticity in [C6I6]2+ and [C6Cl6]2+

Chemical Physics Letters

Volumn 435, Issue 4-6, 2007, Pages 171-175

  Ciofini, Ilaria ^a   Lainé, Philippe P ^b   Adamo, Carlo ^a  

^a PSL RESEARCH UNIVERSITY   (France)

^b UNIVERSITÉ PARIS DESCARTES   (France)

Author keywords

[No Author keywords available]

Indexed keywords

BENZENE; COMPUTATIONAL METHODS; ELECTRON EMISSION; MAGNETIC SHIELDING; PROBABILITY DENSITY FUNCTION;

BENZENE CORE; COMPUTATIONAL PROTOCOL; ELECTRON DELOCALIZATION; MAGNETIC SHIELDING TENSORS;

POSITIVE IONS;

EID: 33846605652     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2006.12.058     Document Type: Article

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