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- W2012605783 abstract "The rotational spectrum of 1,3-benzodioxole has been investigated in the frequency range 30–40 GHz. Six vibrational satellites have been observed and assigned to excited states of the puckering and twisting modes of the five-membered ring moiety. On the basis of the observed zigzag behaviour of the rotational constants upon vibrational excitation, the puckering has been shown to be controlled by a double-minimum potential. Similar changes upon vibrational excitation have been observed for the centrifugal distortion constant Δ JK and for the dipole moment component μ a . These properties have been interpreted by a one-dimensional flexible model for the ring-puckering motion. A two-dimensional model that accounts for both the puckering and the butterfly motion of the two rings contained in the molecule was used to analyse the available far-infrared data and has led to the assignment of 19 observed absorption lines. This analysis has yielded a ring-puckering barrier of 126 cm-1 and an equilibrium structure i..." @default.
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- W2012605783 date "1993-12-20" @default.
- W2012605783 modified "2023-09-29" @default.
- W2012605783 title "Chair conformation and barrier to ring puckering in 1,3-benzodioxole" @default.
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- W2012605783 doi "https://doi.org/10.1080/00268979300103041" @default.
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