The equilibrium structure of HCN

The equilibrium structure of HCN has been determined from the previously published ground state rotational constants of eight isotopomers by using (B0-Be) values obtained from a variational calculation of the vibration–rotation spectrum. The results are re(CH)=1.065 01(8) Å, and re(CN)=1.153 24(2) Å...

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Bibliographic Details
Published in:The Journal of chemical physics 1992-07, Vol.97 (2), p.1606-1607
Main Authors: CARTER, S, MILLS, I. M, HANDY, N. C
Format: Article
Language:English
Subjects:
Atomic and molecular physics
Exact sciences and technology
Molecular properties and interactions with photons
Molecular spectra
Physics
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Summary:The equilibrium structure of HCN has been determined from the previously published ground state rotational constants of eight isotopomers by using (B0-Be) values obtained from a variational calculation of the vibration–rotation spectrum. The results are re(CH)=1.065 01(8) Å, and re(CN)=1.153 24(2) Å.
ISSN:0021-9606
1089-7690
DOI:10.1063/1.463237