The rotation-tunneling spectrum of 3-hydroxypropenal and confirmation of its detection toward IRAS 16293$-$2422 B

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Main Authors: Müller, H. S. P., Coutens, A., Jørgensen, J. K., Margulès, L., Motiyenko, R. A., Guillemin, J. -C.
Format: Preprint
Published: 2024
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author Müller, H. S. P.
Coutens, A.
Jørgensen, J. K.
Margulès, L.
Motiyenko, R. A.
Guillemin, J. -C.
author_facet Müller, H. S. P.
Coutens, A.
Jørgensen, J. K.
Margulès, L.
Motiyenko, R. A.
Guillemin, J. -C.
contents 3-Hydroxypropenal (HOCHCHCHO) is the lower energy tautomer of malonaldehyde which displays a complex rotation-tunneling spectrum. It was detected tentatively toward the solar-type protostar IRAS 16293$-$2422 B with ALMA in the framework of the Protostellar Interferometric Line Survey (PILS). Several transitions, however, had large residuals, preventing not only their detection, but also the excitation temperature of the species from being determined unambiguously. We want to extend the existing rotational line list of 3-hydroxypropenal to shed more light on the recent observational results and to facilitate additional radio astronomical searches for this molecule. We analyzed the rotation-tunneling spectrum of 3-hydroxypropenal in the frequency regions between 150 and 330 GHz and between 400 and 660 GHz. Transitions were searched for in the PILS observations of IRAS 16293$-$2422. Local thermodynamic equilibrium (LTE) models were carried out and compared to the observations to constrain the excitation temperature. Additional transitions were searched for in other ALMA archival data of the same source to confirm the presence of 3-hydroxypropenal. More than 11500 transitions were assigned in the course of our investigation with quantum numbers $2 \le J \le 100$, $K_a \le 59$, and $K_c \le 97$, resulting in a greatly improved set of spectroscopic parameters. The comparison between the LTE models and the observations yields an excitation temperature of 125 K with a column density $N = 1.0 \times 10^{15}$ cm$^{-2}$ for this species. We identified seven additional lines of 3-hydroxypropenal that show a good agreement with the model in the ALMA archive data. The calculated rotation-tunneling spectrum of 3-hydroxypropenal has sufficient accuracy for radio astronomical searches. The detection of 3-hydroxypropenal toward IRAS 16293$-$2422 B is now secure.
format Preprint
id arxiv_https___arxiv_org_abs_2405_01338
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle The rotation-tunneling spectrum of 3-hydroxypropenal and confirmation of its detection toward IRAS 16293$-$2422 B
Müller, H. S. P.
Coutens, A.
Jørgensen, J. K.
Margulès, L.
Motiyenko, R. A.
Guillemin, J. -C.
Astrophysics of Galaxies
Solar and Stellar Astrophysics
Chemical Physics
3-Hydroxypropenal (HOCHCHCHO) is the lower energy tautomer of malonaldehyde which displays a complex rotation-tunneling spectrum. It was detected tentatively toward the solar-type protostar IRAS 16293$-$2422 B with ALMA in the framework of the Protostellar Interferometric Line Survey (PILS). Several transitions, however, had large residuals, preventing not only their detection, but also the excitation temperature of the species from being determined unambiguously. We want to extend the existing rotational line list of 3-hydroxypropenal to shed more light on the recent observational results and to facilitate additional radio astronomical searches for this molecule. We analyzed the rotation-tunneling spectrum of 3-hydroxypropenal in the frequency regions between 150 and 330 GHz and between 400 and 660 GHz. Transitions were searched for in the PILS observations of IRAS 16293$-$2422. Local thermodynamic equilibrium (LTE) models were carried out and compared to the observations to constrain the excitation temperature. Additional transitions were searched for in other ALMA archival data of the same source to confirm the presence of 3-hydroxypropenal. More than 11500 transitions were assigned in the course of our investigation with quantum numbers $2 \le J \le 100$, $K_a \le 59$, and $K_c \le 97$, resulting in a greatly improved set of spectroscopic parameters. The comparison between the LTE models and the observations yields an excitation temperature of 125 K with a column density $N = 1.0 \times 10^{15}$ cm$^{-2}$ for this species. We identified seven additional lines of 3-hydroxypropenal that show a good agreement with the model in the ALMA archive data. The calculated rotation-tunneling spectrum of 3-hydroxypropenal has sufficient accuracy for radio astronomical searches. The detection of 3-hydroxypropenal toward IRAS 16293$-$2422 B is now secure.
title The rotation-tunneling spectrum of 3-hydroxypropenal and confirmation of its detection toward IRAS 16293$-$2422 B
topic Astrophysics of Galaxies
Solar and Stellar Astrophysics
Chemical Physics
url https://arxiv.org/abs/2405.01338