Published January 10, 2014 | Version v1
Journal article

Some insights into formamide formation through gas-phase reactions in the interstellar medium

  • 1. Computational Chemistry Group, Departamento de Química Física, Facultad de Ciencias, Universidad de Valladolid, E-47011 Valladolid (Spain)

Description

We study the viability of different gas-phase ion-molecule reactions that could produce precursors of formamide in the interstellar medium. We analyze different reactions between cations containing a nitrogen atom (NH3+, NH4+, NH3OH+, and NH2OH+) and neutral molecules having one carbonyl group (H2CO and HCOOH). First, we report a theoretical estimation of the reaction enthalpies for the proposed processes. Second, for more favorable reactions, from a thermodynamic point of view, we perform a theoretical study of the potential energy surface. In particular, the more exothermic processes correspond to the reactions of ionized and protonated hydroxylamine with formaldehyde. In addition, a neutral-neutral reaction has also been considered. The analysis of the potential energy surfaces corresponding to these reactions shows that these processes present a net activation barrier and that they cannot be considered as a source of formamide in space.

Availability note (English)

Available from http://dx.doi.org/10.1088/0004-637X/780/2/181

Additional details

Identifiers

Publishing Information

Journal Title
Astrophysical Journal
Journal Volume
780
Journal Issue
2
Journal Page Range
[7 p.]
ISSN
0004-637X
CODEN
ASJOAB