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Microwave spectrum, dipole moment, and structure of 3-aminopropanol

1979; Elsevier BV; Volume: 75; Issue: 2 Linguagem: Inglês

10.1016/0022-2852(79)90118-8

1096-083X

M. A. McMahan, Shikha Sharma, R. F. Curl,

Atmospheric Ozone and Climate

The microwave spectra of 3-aminopropanol and three of its deuterium substituted isotopic species have been investigated in the 26.5 to 40 GHz frequency region. The rotational spectrum of only one conformer has been assigned in which presumably a hydrogen bond of the OH---N type exists. The rotational spectra of a number of excited vibrational states have been observed and assignments made for some of these excited states. The average intensity ratio for the rotational transitions between the ground and excited vibrational states indicates that the first excited state is about 120 cm−1 above the ground state.and the next higher state is roughly 200 cm−1 above the ground vibrational state. The dipole moment was determined from the Stark effect measurements to be 3.13 ± 0.04 D with its principal axes components as |μa| = 2.88 ± 0.03 D, |μb| = 1.23 ± 0.04 D and |μc| = 0.06 ± 0.01 D. The possibility of another conformer where the hydrogen bond could be of NH---O type was explored, but the spectra of such a conformer could not be identified.