On the lack of ring-current aromaticity of (heteroatom) [N]radialenes and their dianions

Chemistry - A European Journal

Volumn 13, Issue 1, 2007, Pages 269-276

  Domene, Carmen ^c   Fowler, Patrick W ^b   Jenneskens, Leonardas W ^a   Steiner, Erich ^d  

^a UTRECHT UNIVERSITY   (Netherlands)

^b UNIVERSITY OF SHEFFIELD   (United Kingdom)

^c UNIVERSITY OF OXFORD   (United Kingdom)

^d UNIVERSITY OF EXETER   (United Kingdom)

Author keywords

Ab initio calculations; Anions; Aromaticity; H ckel theory; Radialenes

Indexed keywords

MOLECULAR STRUCTURE; NEGATIVE IONS; ANGULAR DISTRIBUTION; CALCULATIONS; MOLECULAR ORBITALS;

AROMATICITY; MOLECULAR-ORBITAL ANALYSIS; RADIALENES; SPATIAL DISTRIBUTION;

AROMATIC COMPOUNDS; AROMATIZATION;

ANION; ORGANIC COMPOUND;

ARTICLE; BIOLOGY; CHEMICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY;

ANIONS; COMPUTATIONAL BIOLOGY; MODELS, CHEMICAL; MOLECULAR STRUCTURE; ORGANIC CHEMICALS;

AB INITIO CALCULATIONS; AROMATICITIES; CURRENT DENSITY MAP; HETEROATOMS; MAGNETIC CRITERION; NODAL STRUCTURES; RADIALENES; RING CURRENTS;

EID: 33845915315     PISSN: 09476539     EISSN: 15213765     Source Type: Journal    
DOI: 10.1002/chem.200600507     Document Type: Article

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