Theoretical description of aromaticity in superphane cages

International Journal of Quantum Chemistry

Volumn 80, Issue 2, 2000, Pages 258-263

  Mireles, N ^a   Salcedo, R ^a   Sansores, L E ^a   Martinez A ^a  

^a UNIVERSIDAD NACIONAL AUTÓNOMA DE MÉXICO   (Mexico)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL METHODS; COMPUTER SOFTWARE; MAGNETIC PROPERTIES; MOLECULAR STRUCTURE;

AROMATICITY; HIGHEST OCCUPIED MOLECULAR ORBITALS (HOMO); LOWEST UNOCCUPIED MOLECULAR ORBITALS (LUMO); SOFTWARE PACKAGE B3LYP; SUPERPHANES; TRANSANNULAR PHENOMENA;

CARBON;

EID: 0034298327     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/1097-461X(2000)80:2<258::AID-QUA20>3.0.CO;2-X     Document Type: Article

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