Laboratory Rotational Spectroscopy of CaC <sub>3</sub> N and CaC <sub>4</sub> H

Our understanding of the roles metal-bearing molecules play in interstellar chemistry is limited by the lack of rotational spectroscopic data crucial for astronomical identification/detection. Although calcium is the second most abundant alkaline earth metal in space (after magnesium), only two calcium-bearing molecules have been detected in space, both in the circumstellar envelope of the evolved carbon-rich star IRC+10216. In this work, we report the rotational, fine, and hyperfine structure of two linear calcium-bearing molecules, CaC<sub>3</sub>N and CaC<sub>4</sub>H, in their <sup>2</sup>Σ<sup>+</sup> ground electronic states. These findings both confirm the hypothesized ionic metal-ligand bonding characteristics of this class of molecules that make them potential candidates for optical cooling applications and point the way to detecting these and other calcium-bearing molecules in carbon-rich stars.

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Publication Details

Journal
The Journal of Physical Chemistry A
Published
2025-12-04
DOI
https://doi.org/10.1021/acs.jpca.5c06201
Primary Topic
Astrophysics and Star Formation Studies
Type
article
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article

Laboratory Rotational Spectroscopy of CaC 3 N and CaC 4 H

Joshua H. Baraban, Michael McCarthy, T. M. Gür, P. Bryan Changala
The Journal of Physical Chemistry A
Astrophysics and Star Formation Studies
article

Laboratory Rotational Spectroscopy of CaC 3 N and CaC 4 H

Joshua H. Baraban, Michael McCarthy, T. M. Gür, P. Bryan Changala
article en

Abstract

Our understanding of the roles metal-bearing molecules play in interstellar chemistry is limited by the lack of rotational spectroscopic data crucial for astronomical identification/detection. Although calcium is the second most abundant alkaline earth metal in space (after magnesium), only two calcium-bearing molecules have been detected in space, both in the circumstellar envelope of the evolved carbon-rich star IRC+10216. In this work, we report the rotational, fine, and hyperfine structure of two linear calcium-bearing molecules, CaC<sub>3</sub>N and CaC<sub>4</sub>H, in their <sup>2</sup>Σ<sup>+</sup> ground electronic states. These findings both confirm the hypothesized ionic metal-ligand bonding characteristics of this class of molecules that make them potential candidates for optical cooling applications and point the way to detecting these and other calcium-bearing molecules in carbon-rich stars.

The Journal of Physical Chemistry AVol. 129(50)
Ben-Gurion University of the Negev (IL), Center for Astrophysics Harvard & Smithsonian (US)
Openalex Percentile: Top 74%
Astrophysics and Star Formation Studies
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Laboratory Rotational Spectroscopy of CaC <sub>3</sub> N and CaC <sub>4</sub> H — Joshua H. Baraban, Michael McCarthy, et al. · The Journal of Physical Chemistry A (2025) | TGRS Research Map | TGRS