Literature DB >> 19835087

Rate constants and the H atom branching ratio of the reactions of the methylidyne CH(X2pi) radical with C2H2, C2H4, C3H4 (methylacetylene and allene), C3H6 (propene) and C4H8 (trans-butene).

Jean-Christophe Loison1, Astrid Bergeat.   

Abstract

The reactions of the CH radical with several unsaturated hydrocarbons C2H2 (acetylene), C2H4 (ethylene), C3H4 (methyl-acetylene and allene), C3H6 (propene) and C4H8 (trans-butene) were studied at room temperature, in a low-pressure fast-flow reactor. CH(X2pi, v = 0) radicals were obtained from the reaction of CHBr3 with potassium atoms. The overall rate constants at 300 K are CH + C2H2: (3.6 +/- 0.6) x 10(-10), CH + C2H4: (3.1 +/- 0.6) x 10(-10), CH + C3H4 (methyl-acetylene): (3.4 +/- 0.6) x 10(-10), CH + C3H4 (allene): (3.6 +/- 0.6) x 10(-10), CH + C3H6 (propene): (4.2 +/- 0.8) x 10(-10) and CH + C4H8 (trans-butene): (4.0 +/- 0.80) x 10(-10) cm3 molecule(-1) s(-1) (errors are cited at the level of +/- 1 sigma). Absolute atomic hydrogen production was determined by vacuum ultra-violet (VUV) resonance fluorescence, H production from the CH + CH4 reaction being used as a reference. Observed H branching ratios for these CH reactions were: C2H2: 0.90 +/- 0.08, C2H4: 0.94 +/- 0.08, C3H4 (methyl-acetylene): 0.98 +/- 0.08, C3H4 (allene): 0.97 +/- 0.08, C3H6 (propene): 0.78 +/- 0.10, C4H8 (trans-butene): 0.69 +/- 0.12 (errors are cited at the level of +/- 1 sigma). A compilation of the available kinetic data on these reactions has been made in order to propose rate coefficients for each possible channel of the different reactions for astrochemical models.

Entities:  

Year:  2009        PMID: 19835087     DOI: 10.1039/b812810c

Source DB:  PubMed          Journal:  Phys Chem Chem Phys        ISSN: 1463-9076            Impact factor:   3.676


  8 in total

1.  Formation of benzene in the interstellar medium.

Authors:  Brant M Jones; Fangtong Zhang; Ralf I Kaiser; Adeel Jamal; Alexander M Mebel; Martin A Cordiner; Steven B Charnley
Journal:  Proc Natl Acad Sci U S A       Date:  2010-12-27       Impact factor: 11.205

2.  Theoretical mechanistic study of the reaction of the methylidyne radical with methylacetylene.

Authors:  Lili Zhang; Hui-Ling Liu; Guang-Hui Yang; Xu-Ri Huang; Yan Li; Yan-Bo Sun; Chia-Chung Sun
Journal:  J Mol Model       Date:  2011-03-02       Impact factor: 1.810

3.  Discovery of CH2CHCCH and detection of HCCN, HC4N, CH3CH2CN, and, tentatively, CH3CH2CCH in TMC-1.

Authors:  J Cernicharo; M Agúndez; C Cabezas; N Marcelino; B Tercero; J R Pardo; J D Gallego; F Tercero; J A López-Pérez; P de Vicente
Journal:  Astron Astrophys       Date:  2021-03-10       Impact factor: 5.802

4.  Pure hydrocarbon cycles in TMC-1: Discovery of ethynyl cyclopropenylidene, cyclopentadiene and indene.

Authors:  J Cernicharo; M Agúndez; C Cabezas; B Tercero; N Marcelino; J R Pardo; P de Vicente
Journal:  Astron Astrophys       Date:  2021-05-13       Impact factor: 5.802

5.  The growth of carbon chains in IRC +10216 mapped with ALMA.

Authors:  M Agúndez; J Cernicharo; G Quintana-Lacaci; A Castro-Carrizo; L Velilla Prieto; N Marcelino; M Guélin; C Joblin; J A Martín-Gago; C A Gottlieb; N A Patel; M C McCarthy
Journal:  Astron Astrophys       Date:  2017-05       Impact factor: 5.802

6.  Revisiting the Intriguing Electronic Features of the BeOBeC Carbyne and Some Isomers: A Quantum-Chemical Assessment.

Authors:  Jilai Li; Caiyun Geng; Thomas Weiske; Mingfei Zhou; Jun Li; Helmut Schwarz
Journal:  Angew Chem Int Ed Engl       Date:  2020-07-28       Impact factor: 15.336

7.  Theoretical insights into the reaction mechanisms between 2,3,7,8-tetrachlorodibenzofuran and the methylidyne radical.

Authors:  Wenjing Wei; Weihua Wang; Kaining Xu; Wenling Feng; Xiaoping Li; Ping Li
Journal:  RSC Adv       Date:  2018-06-08       Impact factor: 3.361

8.  Theoretical Investigations on the Reactivity of Methylidyne Radical toward 2,3,7,8-Tetrachlorodibenzo-p-Dioxin: A DFT and Molecular Dynamics Study.

Authors:  Weihua Wang; Wenling Feng; Wenliang Wang; Ping Li
Journal:  Molecules       Date:  2018-10-18       Impact factor: 4.411

  8 in total

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