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Dimethyl ether is one of the most abundant interstellar complex organic molecules. Yet its formation route remains elusive. In this work, we have performed electronic structure and kinetics calculations to derive the rate coefficients for…

Polycyclic aromatic hydrocarbons (PAHs) appear to be ubiquitous in terrestrial atmosphere as well as in the interstellar medium (ISM). In the astrophysical context presence of PAHs is interpreted by the observations of mid-IR emission bands…

Chemical Physics · Physics 2019-03-26 Rashmi Singh , Shantanu Rastogi

A gas-phase formation route is proposed for the recently detected propargylimine molecule. In analogy to other imines, such as cyanomethanimine, the addition of a reactive radical (C$_2$H in the present case) to methanimine (CH$_2$NH})…

Astrophysics of Galaxies · Physics 2020-11-18 Jacopo Lupi , Cristina Puzzarini , Vincenzo Barone

The fullerene C$_{60}$, one of the largest molecules identified in the interstellar medium (ISM), has been proposed to form top-down through the photo-chemical processing of large (more than 60 C-atoms) polycyclic aromatic hydrocarbon (PAH)…

Instrumentation and Methods for Astrophysics · Physics 2019-02-20 Weiwei Zhang , Yubing Si , Junfeng Zhen , Tao Chen , Harold Linnartz , Alexander G. G. M. Tielens

Fullerenes are a particularly stable class of carbon molecules in the shape of a hollow sphere or ellipsoid that might be formed in the outflows of carbon stars. Once injected into the interstellar medium (ISM), these stable species survive…

Astrophysics of Galaxies · Physics 2014-07-04 J. Bernard-Salas , J. Cami , A. P. Jones , E. Peeters , E. R. Micelotta , M. Otsuka , G. C. Sloan , F. Kemper , M. Groenewegen

Small aromatic molecules, including functionalized derivatives of benzene, are known to be present throughout the different stages of star and planet formation. In particular, oxygen-bearing monosubstituted aromatics, likely including…

A reliable and compact chemical mechanism of gas-phase methane pyrolysis leading to formation of large polycyclic aromatic hydrocarbon (PAH) molecules has been developed. This model is designed for studies of carbon nanostructure synthesis…

Chemical Physics · Physics 2023-11-03 Alexander Khrabry , Igor D. Kaganovich , Yuri Barsukov , Sumathy Raman , Emre Turkoz , David Graves

Circumstellar envelopes (CEs) around evolved stars are an active site for the production of molecules. After evolving through the Asymptotic Giant Branch (AGB), proto-planetary nebula (PPN), to planetary nebula (PN) phases, CEs ultimately…

Solar and Stellar Astrophysics · Physics 2017-11-15 Yong Zhang

A novel theoretical method is developed to study the polycyclic aromatic hydrocarbon - diffuse interstellar band (PAH-DIB) hypothesis. In this method, a computer program is used to enumerate all PAH molecules with up to a specific number of…

Astrophysics · Physics 2007-05-23 Xiaofeng Tan

Emission from a class of benzene-based molecules known as Polycyclic Aromatic Hydrocarbons (PAHs) dominates the infrared spectrum of star-forming regions. The observed emission appears to arise from the combined emission of numerous PAH…

Instrumentation and Methods for Astrophysics · Physics 2014-03-20 Kevin H. Knuth , Man Kit Tse , Joshua Choinsky , Haley A. Maunu , Duane F. Carbon

Interstellar polycyclic aromatic hydrocarbons (PAHs) are expected to be strongly processed by vacuum ultraviolet photons. Here, we report experimental studies on the ionization and fragmentation of coronene (C24H12), ovalene (C32H14) and…

Recent interstellar detections include a significant number of molecules containing vinyl (C2H3) and ethyl (C2H5) groups in their structure. For several of these molecules, there is not a clear experimental or theoretical evidence that…

Astrophysics of Galaxies · Physics 2022-09-07 German Molpeceres , Victor M. Rivilla

The hydrogenation of polycyclic aromatic hydrocarbons (PAHs) is crucial to understanding molecular hydrogenation formation in the interstellar medium. This process also helps to elucidate the weakening of the aromatic bonds in PAHs, which…

Astrophysics of Galaxies · Physics 2025-09-03 S. Haid , K. Gugeler , J. Kästner , D. Campisi

In the interstellar medium (ISM), polycylic aromatic hydrocarbons (PAHs) are believed to be an important carbon reservoir, accounting for up to a quarter of all interstellar carbon in our galaxy. This makes the investigation of their…

Astrophysics of Galaxies · Physics 2025-06-23 Karina Sogomonyan , Malek Ben Khalifa , Phoebe Pierré , Jérôme Loreau

Polycyclic aromatic hydrocarbons (PAHs) play a key role in the chemical and hydrodynamical evolution of the atmospheres of exoplanets and planet-forming discs. If they can survive the planet formation process, PAHs are likely to be involved…

Earth and Planetary Astrophysics · Physics 2022-03-09 Barbara Ercolano , Christian Rab , Karan Molaverdikhani , Billy Edwards , Thomas Preibisch , Leonardo Testi , Inga Kamp , Wing-Fai Thi

Carbon ($^3$P) atom is a reactive species that, according to laboratory experiments and theoretical calculations, condensates with interstellar ice components. This fact is of uttermost importance for the chemistry in the interstellar…

Astrophysics of Galaxies · Physics 2023-07-19 Stefano Ferrero , Cecilia Ceccarelli , Piero Ugliengo , Mariona Sodupe , Albert Rimola

The low temperature reaction between CN and benzene (C$_6$H$_6$) is of significant interest in the astrochemical community due to the recent detection of benzonitrile, the first aromatic molecule identified in the interstellar medium (ISM)…

Astrophysics of Galaxies · Physics 2020-03-25 Ilsa R. Cooke , Divita Gupta , Joseph P. Messinger , Ian R. Sims

The formation of polycyclic aromatic hydrocarbons (PAHs) and their methyl derivatives occurs mainly in the dust shells of asymptotic giant branch (AGB) stars. The bands at 3.3 and 3.4 $\mu$m, observed in infrared emission spectra of several…

Solar and Stellar Astrophysics · Physics 2016-04-20 T. Monfredini , F. Fantuzzi , M. A. C. Nascimento , W. Wolff , H. M. Boechat-Roberty

Astrochemistry lies at the nexus of astronomy, chemistry, and molecular physics. On the basis of precise laboratory data, a rich collection of more than 200 familiar and exotic molecules have been identified in the interstellar medium, the…

Astrophysics of Galaxies · Physics 2021-03-18 Michael C. McCarthy , Brett A. McGuire

The formation of double and triple C-C bonds from the processing of pure c-C6H12 (cyclohexane) and mixed H2O:NH3:c-C6H12 (1:0.3:0.7) ices by highly-charged, and energetic ions (219 MeV O^{7+} and 632 MeV Ni^{24+}) is studied. The…

Astrophysics of Galaxies · Physics 2015-06-04 S. Pilling , D. P. P. Andrade , E. F. da Silveira , H. Rothard , A. Domaracka , P. Boduch