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Record W4403123281 · doi:10.1051/0004-6361/202451674

Destruction of interstellar methyl cyanide (CH<sub>3</sub>CN) via collisions with He<sup>+⋅</sup> ions

2024· article· en· W4403123281 on OpenAlexfundno aff
Luca Mancini, Emília Valença Ferreira de Aragão, Fernando Pirani, Marzio Rosi, Noelia Faginas‐Lago, Vincent Richardson, Luca Martini, L. Podio, Manuela Lippi, C. Codella, Daniela Ascenzi

Bibliographic record

VenueAstronomy and Astrophysics · 2024
Typearticle
Languageen
FieldPhysics and Astronomy
TopicAtomic and Molecular Physics
Canadian institutionsnot available
FundersInstitut sur la Nutrition et les Aliments FonctionnelsUniversità degli Studi di TrentoH2020 Marie Skłodowska-Curie ActionsAgenzia Spaziale ItalianaMinistero dell’Istruzione, dell’Università e della RicercaEuropean Commission
KeywordsPhysicsIonAstrophysicsCyanideInterstellar mediumAstrochemistryAstronomyAstrobiologyAtomic physicsGalaxyInorganic chemistry

Abstract

fetched live from OpenAlex

Context . CH 3 CN (methyl cyanide) is one of the simplest and most abundant interstellar complex organic molecules (iCOMs), and has been detected in young solar analogues, shocked regions, protoplanetary discs, and comets. CH 3 CN can therefore be considered a key species to explore the chemical connections between the planet-forming disk phase and comets. However, for such comparison to be meaningful, kinetics data for the reactions leading to CH 3 CN formation and destruction must be updated. Aims . Here we focus on the destruction of methyl cyanide through collisions with He +. . We employed a combined experimental and theoretical methodology to obtain cross sections (CSs) and branching ratios (BRs) as a function of collision energy, from which we calculated reaction rate coefficients k ( T ) in the temperature range from 10 to 300 K. Methods . We measured CSs and BRs using a guided ion beam setup, and developed a theoretical treatment based on an analytical formulation of the potential energy surfaces (PESs) for the charge exchange process. The method employs a Landau Zener model to obtain reaction probabilities at crossings between the entrance and exit PESs, and an adiabatic centrifugal sudden approximation to calculate CSs and k ( T ), from subthermal to hyper-thermal regimes. Results. k ( T ) and experimental BRs differ from those predicted from widely used capture models. In particular, the rate coefficient at 10 K is estimated to be almost one order of magnitude smaller than what is reported in the KIDA database. In addition, the charge exchange is completely dissociative and the most abundant fragments are HCCN + /CCNH + , HCNH + and CH 2 + . Conclusions . Our results, combined with a revised chemical network for the formation of CH 3 CN, support the hypothesis that methyl cyanide in protoplanetary discs could be mostly the product of gas-phase processes rather than grain chemistry, as currently proposed. These findings are expected to have implications in the comparison of the abundance ratios of N-bearing molecules observed in discs with cometary abundance ratios.

Fetched live from OpenAlex and de-inverted. Abstracts are not stored in this database: the inverted indexes are 8.6 GB of the frame’s 9.3 GB of text, and the host has 13 GB free.

How this classification was reachedexpand

Full frame distilled prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. Learned from the 10,348 direct Codex labels and 10,348 direct Gemma labels. Candidate is the union of thresholded teacher heads; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels or direct frontier model labels.

metaresearch head score (Codex)0.000
metaresearch head score (Gemma)0.000
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesMeta-epidemiology (narrow)
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Bench or experimental · Consensus signal: none
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.835
Threshold uncertainty score1.000

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.000
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0000.000
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0000.000

Machine scores (provisional)

The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.

Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.

Opus teacher head0.005
GPT teacher head0.200
Teacher spread0.196 · how far apart the two teachers sit on this one work
Validation statusscore_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from it

Classification

machine, unvalidated

Machine predicted; a candidate call from one teacher head, not a consensus.

Study designBench or experimental
Domainnot available
GenreEmpirical

How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".

Quick stats

Citations5
Published2024
Admission routes1
Has abstractyes

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