THE MICROWAVE SPECTRUM AND CONFORMATION OF METHOXY $OZONIDE (H_{3}COCHOOCH_{2}O)$

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1986

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Ohio State University

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The microwave spectrum of methoxy ozonide (3-methoxy-1,2,4-trioxolane) has been assigned. The ground state rotational constants for the parent species are: A=4815.375(4)MHz,B≡2435.842(3)MHz and C=2336.66(4)MHz. Spectra have also been assigned for the three species singly deuterated on the ring as well as the 5,5=d2 species, the 3,5,5=d3 species and the OCD3 species. For the trans=d1 and the OCD3 species only Q branch transitions have been assigned. A least-squares fit of the structure to twenty-two inertial parameters including moments of inertia, A-C, and Kappa indicates an axial methoxy group oriented over the ring. The dihedral angle Oe=C=O=CH3 is approximately 55 where Oe is the ether oxygen.

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Address of LaBarge and Kuczkowski: Department of Chemistry, University of Michigan, Ann Arbor, Michigan 48109. Address of Keul: Lehrstuhl f""{u}r Textilchemie und Makromoleculare Chemie, der RWTH, Aachen, West Germany.


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