On the electronic structure of a dianion, a radical anion, and a neutral biradical (HB)11C{single bond}C{triple bond, long}C{single bond}C(BH)11 carborane dimer

Journal of Molecular Structure: THEOCHEM

Volumn 912, Issue 1-3, 2009, Pages 13-20

  Oliva, Josep M ^a   Serrano Andrés, Luis ^b   Havlas, Zdeněk ^c   Michl, Josef ^c  

^a INSTITUTO DE QUÍMICA FÍSICA ROCASOLANO   (Spain)

^b UNIVERSITY OF VALENCIA   (Spain)

^c INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY   (Czech Republic)

Author keywords

(Bi)radical; Carborane; CASPT2; DFT; Molecular architecture; Triplet

Indexed keywords

EID: 69949189702     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2009.01.033     Document Type: Article

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