Cargando…

An ortho­rhom­bic polymorph of 2-(1,3,5-di­thia­zinan-5-yl)ethanol or MEA-di­thia­zine

Substituted triazines are a class of compounds utilized for scavenging and sequestering hydrogen sulfide in oil and gas production operations. The reaction of one of these triazines under field conditions resulted in the formation of the title compound, 2-(1,3,5-di­thia­zinan-5-yl)ethanol, C(5)H(11)...

Descripción completa

Detalles Bibliográficos
Autores principales: Schultheiss, Nate, Holtsclaw, Jeremy, Zeller, Matthias
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8819450/
https://www.ncbi.nlm.nih.gov/pubmed/35145749
http://dx.doi.org/10.1107/S2056989022000342
_version_ 1784646064729489408
author Schultheiss, Nate
Holtsclaw, Jeremy
Zeller, Matthias
author_facet Schultheiss, Nate
Holtsclaw, Jeremy
Zeller, Matthias
author_sort Schultheiss, Nate
collection PubMed
description Substituted triazines are a class of compounds utilized for scavenging and sequestering hydrogen sulfide in oil and gas production operations. The reaction of one of these triazines under field conditions resulted in the formation of the title compound, 2-(1,3,5-di­thia­zinan-5-yl)ethanol, C(5)H(11)NOS(2), or MEA-di­thia­zine. Polymorphic form I, in space group I4(1)/a, was first reported in 2004 and its extended structure displays one-dimensional, helical strands connected through O—H⋯O hydrogen bonds. We describe here the form II polymorph of the title compound, which crystallizes in the ortho­rhom­bic space group Pbca as centrosymmetric dimers through pairwise O—H⋯N hydrogen bonds from the hydroxyl moiety to the nitro­gen atom of an adjacent mol­ecule.
format Online
Article
Text
id pubmed-8819450
institution National Center for Biotechnology Information
language English
publishDate 2022
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-88194502022-02-09 An ortho­rhom­bic polymorph of 2-(1,3,5-di­thia­zinan-5-yl)ethanol or MEA-di­thia­zine Schultheiss, Nate Holtsclaw, Jeremy Zeller, Matthias Acta Crystallogr E Crystallogr Commun Research Communications Substituted triazines are a class of compounds utilized for scavenging and sequestering hydrogen sulfide in oil and gas production operations. The reaction of one of these triazines under field conditions resulted in the formation of the title compound, 2-(1,3,5-di­thia­zinan-5-yl)ethanol, C(5)H(11)NOS(2), or MEA-di­thia­zine. Polymorphic form I, in space group I4(1)/a, was first reported in 2004 and its extended structure displays one-dimensional, helical strands connected through O—H⋯O hydrogen bonds. We describe here the form II polymorph of the title compound, which crystallizes in the ortho­rhom­bic space group Pbca as centrosymmetric dimers through pairwise O—H⋯N hydrogen bonds from the hydroxyl moiety to the nitro­gen atom of an adjacent mol­ecule. International Union of Crystallography 2022-01-14 /pmc/articles/PMC8819450/ /pubmed/35145749 http://dx.doi.org/10.1107/S2056989022000342 Text en © Schultheiss et al. 2022 https://creativecommons.org/licenses/by/4.0/This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Research Communications
Schultheiss, Nate
Holtsclaw, Jeremy
Zeller, Matthias
An ortho­rhom­bic polymorph of 2-(1,3,5-di­thia­zinan-5-yl)ethanol or MEA-di­thia­zine
title An ortho­rhom­bic polymorph of 2-(1,3,5-di­thia­zinan-5-yl)ethanol or MEA-di­thia­zine
title_full An ortho­rhom­bic polymorph of 2-(1,3,5-di­thia­zinan-5-yl)ethanol or MEA-di­thia­zine
title_fullStr An ortho­rhom­bic polymorph of 2-(1,3,5-di­thia­zinan-5-yl)ethanol or MEA-di­thia­zine
title_full_unstemmed An ortho­rhom­bic polymorph of 2-(1,3,5-di­thia­zinan-5-yl)ethanol or MEA-di­thia­zine
title_short An ortho­rhom­bic polymorph of 2-(1,3,5-di­thia­zinan-5-yl)ethanol or MEA-di­thia­zine
title_sort ortho­rhom­bic polymorph of 2-(1,3,5-di­thia­zinan-5-yl)ethanol or mea-di­thia­zine
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8819450/
https://www.ncbi.nlm.nih.gov/pubmed/35145749
http://dx.doi.org/10.1107/S2056989022000342
work_keys_str_mv AT schultheissnate anorthorhombicpolymorphof2135dithiazinan5ylethanolormeadithiazine
AT holtsclawjeremy anorthorhombicpolymorphof2135dithiazinan5ylethanolormeadithiazine
AT zellermatthias anorthorhombicpolymorphof2135dithiazinan5ylethanolormeadithiazine
AT schultheissnate orthorhombicpolymorphof2135dithiazinan5ylethanolormeadithiazine
AT holtsclawjeremy orthorhombicpolymorphof2135dithiazinan5ylethanolormeadithiazine
AT zellermatthias orthorhombicpolymorphof2135dithiazinan5ylethanolormeadithiazine