RING-PUCKERING POTENTIAL FUNCTIONS OF SOME OXYGEN- CONTAINING MOLECULES.

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1969

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Ohio State University

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The far-infrared absorption spectra of gaseous cyclopentene oxide, 2-methyl-4,5-dihydrofuran and cyclopentanone have been observed in the range 250−25cm−1. The oxygen atom in cyclo-pentene oxide introduces asymmetry into the potential function for inversion of the five-membered ring. The eigenvalues of the inversion vibration can be inferred from the spectra and fitted to a potential function of the form V(x)=ax4bx2+cx3, in which x is the ring-inversion coordinate. The absorption of 2-methyl-4,5-dihydrofuran is complicated by several low-frequency modes but the spectrum can be fairly well interpreted with a double-minimum potential function of the form V(x)=ax4bx2 with a barrier height of 98cm−1. Seven sharp Q branches were observed for cyclopentanone which were fitted to a hindered pseudorotational potential function of the form V=V2(1−cos⁡2ϕ)/2+V4(1−cos⁡4ϕ)/2. The values of V2 and V4 are respectively 1303 and 29cm−1.

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This work was supported by the National Science Foundation.


Author Institution: Spectroscopy Laboratory, Massachusetts Institute of Technology, Cambridge

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