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Study of lithium cation perturbation on the spin density distribution in sym-trinitrobenzene radical anion

✍ Scribed by R.K. Gupta; J. Subramanian; N.K. Ray; P.T. Narasimhan

Publisher: Elsevier Science
Year: 1968
Tongue: English
Weight: 377 KB
Volume: 2
Category: Article
ISSN: 0009-2614
DOI: 10.1016/0009-2614(68)85028-6

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✦ Synopsis

The effect of lithium cation association on the spin density distribution in sym-Trinitrobenzene radical anion has been studied here both experimentnl:y and theoretically.

The experimental observations can be satisfactorily explained by simple HUckel molecular orbital calculations only when the cation is assumed to be tightly bound to one of the nitro groups.

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