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Laboratory spectroscopy, theoretical characterization, and astronomical search for syn-propenethial (CH2CHCHS)

2026-07-27 · arXiv: 2607.24656

One-line summary

A solar energy research paper on Laboratory spectroscopy, theoretical characterization, and astronomical search for syn-propenethial (CH2CHCHS).

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Chinese explanation / 中文解读

中文解读待补充:本站会优先为光伏效率、钙钛矿太阳能电池、储能技术、太阳能热利用、BIPV、并网技术等高价值论文补充中文说明。

Original abstract

We report the laboratory characterization of the higher-energy isomer of propenethial, syn-CH2CHCHS. While the lower-energy isomer, anti-CH2CHCHS, was detected in the interstellar medium during the QUIJOTE line survey of TMC-1, we report the non-detection of the syn isomer in the same source, deriving an upper limit to its column density of 1.5 $\times$ 10$^{10}$ cm$^{-2}$. A subsequent theoretical investigation into the origin of this non-detection reveals that the most plausible formation pathway for CH2CHCHS is highly isomer-specific, producing nearly 95\% of the anti isomer. This predicted branching ratio allows us to infer an even lower effective upper limit for the abundance of the syn isomer. In addition, calculations of tunneling-mediated unimolecular isomerization in the gas phase show that syn-CH2CHCHS converts to the lower-energy anti isomer on timescales of the order of 10$^{3}$ years. Overall, we conclude that the detection of syn-CH2CHCHS is highly challenging in both cold and warm interstellar environments. These results underscore the importance of electronic-structure and kinetic effects in determining isomer abundances across diverse interstellar environments.

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