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• W2015016589 abstract "The infrared spectrum of gaseous 1-pyrazoline has been measured from 33 to 4000 cm−1. The infrared and Raman spectra of the corresponding liquid sample have also been recorded. A vibrational assignment of the fundamentals is proposed which is consistent with the Cs equilibrium configuration. The assignment is based on the gas-phase band contours, the depolarization values, and group frequency correlations. A series of 13 pronounced Q branches was observed in the far-infrared spectral region, and they have been attributed to the strongly anharmonic ring-puckering vibration. Although the far-infrared frequencies could be reproduced by two different potential functions, a double minimum potential of the form V = 23.40(z4 − 4.40z2) where z is the reduced ring-puckering coordinate provides the most satisfactory interpretation of all the spectral data. The height of the inversion barrier is calculated to be 113 cm−1, and the equilibrium angle between the two dihedral planes of the puckered ring is 19.7° ± 1.0°. The results are compared with those obtained on cyclopentene." @default.
• W2015016589 created "2016-06-24" @default.
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• W2015016589 date "1970-06-15" @default.
• W2015016589 modified "2023-09-23" @default.
• W2015016589 title "Vibrational Spectra and Structure of Small Ring Molecules. XVI. Vibrational Analysis and Ring-Puckering Vibration of 1-Pyrazoline" @default.
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• W2015016589 doi "https://doi.org/10.1063/1.1672912" @default.
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