Literature DB >> 29142332

The interstellar chemistry of C3H and C3H2 isomers.

Jean-Christophe Loison1, Marcelino Agúndez2, Valentine Wakelam3, Evelyne Roueff4, Pierre Gratier3, Núria Marcelino5, Dianailys Nuñez Reyes1, José Cernicharo2, Maryvonne Gerin6.   

Abstract

We report the detection of linear and cyclic isomers of C3H and C3H2 towards various starless cores and review the corresponding chemical pathways involving neutral (C3Hx with x=1,2) and ionic (C3Hx+ with x = 1,2,3) isomers. We highlight the role of the branching ratio of electronic Dissociative Recombination (DR) reactions of C3H2+ and C3H3+ isomers showing that the statistical treatment of the relaxation of C3H* and C3H2* produced in these DR reactions may explain the relative c,l-C3H and c,l-C3H2 abundances. We have also introduced in the model the third isomer of C3H2 (HCCCH). The observed cyclic-to-linear C3H2 ratio vary from 110 ± 30 for molecular clouds with a total density around 1×104 molecules.cm-3 to 30 ± 10 for molecular clouds with a total density around 4×105 molecules.cm-3, a trend well reproduced with our updated model. The higher ratio for low molecular cloud densities is mainly determined by the importance of the H + l-C3H2 → H + c-C3H2 and H + t-C3H2 → H + c-C3H2 isomerization reactions.

Entities:  

Keywords:  ISM: abundances; ISM: clouds; ISM: molecules; astrochemistry

Year:  2017        PMID: 29142332      PMCID: PMC5683352          DOI: 10.1093/mnras/stx1265

Source DB:  PubMed          Journal:  Mon Not R Astron Soc        ISSN: 0035-8711            Impact factor:   5.287


  19 in total

1.  Highly accurate quartic force fields, vibrational frequencies, and spectroscopic constants for cyclic and linear C3H3(+).

Authors:  Xinchuan Huang; Peter R Taylor; Timothy J Lee
Journal:  J Phys Chem A       Date:  2011-04-21       Impact factor: 2.781

2.  Triplet states of cyclopropenylidene and its isomers.

Authors:  Qunyan Wu; Qianyi Cheng; Yukio Yamaguchi; Qianshu Li; Henry F Schaefer
Journal:  J Chem Phys       Date:  2010-01-28       Impact factor: 3.488

3.  Knowledge-based probabilistic representations of branching ratios in chemical networks: the case of dissociative recombinations.

Authors:  Sylvain Plessis; Nathalie Carrasco; Pascal Pernot
Journal:  J Chem Phys       Date:  2010-10-07       Impact factor: 3.488

4.  A correlated ab initio study of linear carbon-chain radicals CnH (n = 2-7).

Authors:  D E Woon
Journal:  Chem Phys Lett       Date:  1995-09-29       Impact factor: 2.328

5.  Calculations concerning interstellar isomeric abundance ratios for C3H and C3H2.

Authors:  S A Maluendes; A D McLean; E Herbst
Journal:  Astrophys J       Date:  1993-11-01       Impact factor: 5.874

6.  Calculations on the competition between association and reaction for C3H(+) + H2.

Authors:  S A Maluendes; A D McLean; K Yamashita; E Herbst
Journal:  J Chem Phys       Date:  1993-08-15       Impact factor: 3.488

7.  Structure of triplet propynylidene (HCCCH) as probed by IR, UV/vis, and EPR spectroscopy of isotopomers.

Authors:  Randal A Seburg; Eric V Patterson; Robert J McMahon
Journal:  J Am Chem Soc       Date:  2009-07-08       Impact factor: 15.419

8.  High-accuracy extrapolated ab initio thermochemistry of the propargyl radical and the singlet C(3)H(2) carbenes.

Authors:  Juana Vázquez; Michael E Harding; Jürgen Gauss; John F Stanton
Journal:  J Phys Chem A       Date:  2009-11-12       Impact factor: 2.781

9.  Temperature variable ion trap studies of C3Hn+ with H2 and HD.

Authors:  I Savić; D Gerlich
Journal:  Phys Chem Chem Phys       Date:  2005-03-07       Impact factor: 3.676

10.  The interstellar chemistry of H2C3O isomers.

Authors:  Jean-Christophe Loison; Marcelino Agúndez; Núria Marcelino; Valentine Wakelam; Kevin M Hickson; José Cernicharo; Maryvonne Gerin; Evelyne Roueff; Michel Guélin
Journal:  Mon Not R Astron Soc       Date:  2016-03-11       Impact factor: 5.287

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  7 in total

1.  Cumulene carbenes in TMC-1: Astronomical discovery of l-H2C5 .

Authors:  C Cabezas; B Tercero; M Agúndez; N Marcelino; J R Pardo; P de Vicente; J Cernicharo
Journal:  Astron Astrophys       Date:  2021-06-15       Impact factor: 5.802

2.  First detection of doubly deuterated methyl acetylene (CHD2CCH and CH2DCCD).

Authors:  M Agúndez; E Roueff; C Cabezas; J Cernicharo; N Marcelino
Journal:  Astron Astrophys       Date:  2021-06-01       Impact factor: 5.802

3.  The sulphur saga in TMC-1: Discovery of HCSCN and HCSCCH.

Authors:  J Cernicharo; C Cabezas; Y Endo; M Agúndez; B Tercero; J R Pardo; N Marcelino; P de Vicente
Journal:  Astron Astrophys       Date:  2021-06-23       Impact factor: 5.802

4.  Gas-phase kinetics of CH3CHO with OH radicals between 11.7 and 177.5 K.

Authors:  Sergio Blázquez; Daniel González; Elias M Neeman; Bernabé Ballesteros; Marcelino Agúndez; André Canosa; José Albaladejo; José Cernicharo; Elena Jiménez
Journal:  Phys Chem Chem Phys       Date:  2020-09-23       Impact factor: 3.676

5.  Oxygen fractionation in dense molecular clouds.

Authors:  Jean-Christophe Loison; Valentine Wakelam; Pierre Gratier; Kevin M Hickson; Aurore Bacmann; Marcelino Agùndez; Nuria Marcelino; José Cernicharo; Viviana Guzman; Maryvonne Gerin; Javier R Goicoechea; Evelyne Roueff; Franck Le Petit; Jérome Pety; Asunción Fuente; Pablo Riviere-Marichalar
Journal:  Mon Not R Astron Soc       Date:  2019-02-27       Impact factor: 5.287

6.  A sensitive λ 3 mm line survey of L483: A broad view of the chemical composition of a core around a Class 0 object.

Authors:  M Agúndez; N Marcelino; J Cernicharo; E Roueff; M Tafalla
Journal:  Astron Astrophys       Date:  2019-05-29       Impact factor: 5.802

7.  Gas-Phase Vibrational Spectroscopy of the Hydrocarbon Cations l-C3H+, HC3H+, and c-C3H2+: Structures, Isomers, and the Influence of Ne-Tagging.

Authors:  Sandra Brünken; Filippo Lipparini; Alexander Stoffels; Pavol Jusko; Britta Redlich; Jürgen Gauss; Stephan Schlemmer
Journal:  J Phys Chem A       Date:  2019-09-05       Impact factor: 2.781

  7 in total

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