A study of the conformational isomerism of n-propyl nitrate by microwave spectroscopy
Stephens, Susanna L.
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https://hdl.handle.net/2142/104430
Description
Title
A study of the conformational isomerism of n-propyl nitrate by microwave spectroscopy
Author(s)
Stephens, Susanna L.
Contributor(s)
Blake, Thomas A.
Brauer, Carolyn
Cooke, S.A.
Novick, Stewart E.
Orellana, W.
Issue Date
2019-06-18
Keyword(s)
Conformers and isomers
Abstract
The rotational spectrum of n-propyl nitrate was measured in the frequency range between 6-18 GHz using a Balle-Flygare Fourier transform microwave jet/cavity spectrometer. Parent, $^{13}$C and $^{15}$N isotopologue transitions for the lower-energy anti-gauche (AG) conformer were found using this instrument. The search for spectra from other conformers was performed using a broadband chirped-pulse jet spectrometer. Transitions from the anti-anti (AA) conformer were observed in this manner. Parent, $^{13}$C and $^{15}$N isotopologue transitions for the AA conformer were rescanned using the cavity instrument to improve resolution and the signal-to-noise ratio. Rotational, centrifugal distortion, and nuclear electric quadrupole coupling constants for all conformers/isotopologues were fit using Pickett’s SPFIT program. The structure of n-propyl nitrate will be discussed in light of these results.
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