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Abstract
Abstract The rotational constants A, B, C are functions from the vibrational quantum numbers for the out-of-plane ring bending vibration of 3-methyleneoxetane. Gibson and Harris [1] using microwave spectroscopy had given the dependence between quantum vibrational numbers for the out-of-plane bending mode and rotational constants. In this paper, the agreement between experimental results from the microwave measurements and theoretical ones from the CNDO/2 is analysed. The planarity for the strained four-member ring is confirmed from the information available. The position corresponding to the methylene groups is also predicted from CNDO/2 calculations.
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