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On the electronic structure of a dianion, a radical anion, and a neutral biradical (HB)11C-C=C-C(BH)11 carborane dimer
- 1.0333072 - ÚOCHB 2010 RIV NL eng J - Journal Article
Oliva, J. M. - Serrano-Andrés, L. - Havlas, Zdeněk - Michl, Josef
On the electronic structure of a dianion, a radical anion, and a neutral biradical (HB)11C-C=C-C(BH)11 carborane dimer.
Journal of Molecular Structure. Theochem. Roč. 912, 1/3 (2009), s. 13-20. ISSN 0166-1280
R&D Projects: GA AV ČR IAA400550708
Institutional research plan: CEZ:AV0Z40550506
Keywords : (Bi)radical * DFT * CASPT2 * molecular architecture * triplet
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 1.216, year: 2009
Electronic structure of the dianion, a radical anion, and neutral biradical (BH)11C-C=C-C(BH)11 of the carborane dimer is analzyed by quantum chemical methods.
Permanent Link: http://hdl.handle.net/11104/0178149
Number of the records: 1