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Determination of the zero point energy difference of trans- and cis-(NO)2 from the equilibrium constant of nitric oxide dimerization

✍ Scribed by Z. Slanina

Publisher: Elsevier Science
Year: 1977
Tongue: English
Weight: 426 KB
Volume: 52
Category: Article
ISSN: 0009-2614
DOI: 10.1016/0009-2614(77)85132-4

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✦ Synopsis

IZccelved 5 July 1977 Amlysis of the cqu111bru~n constant of NO ~:II.IIc.II duncrlzdtx)n t,rken as the result of two p.lrtral equiltbria Icd to ri v;rlue of -301 + 5 J/r1101 for the zero point cncrgy dlffercncc of tr.ulr-.md cis-(NO) 2. I'ronl d conip.lrlcon of tlii\ v.tlue with rcccnt al) initio cnlculdtionc the diIfcrcncc between the correlation cnergics of titc two lsorncrs was chm.ltcti ~1s 8 ?: 3 kJ/mol.

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