2-Ureido-1,3-thia-zol-3-ium dihydrogen phosphate.

Acta Crystallogr Sect E Struct Rep Online

National Taras Shevchenko University, Department of Chemistry, Volodymyrska Street 64, 01033 Kyiv, Ukraine.

Published: July 2011

The title compound, C(4)H(6)N(3)OS(+)·H(2)PO(4) (-), (I), was obtained as a result of hydrolysis of [(1,3-thia-zol-2-yl-amino)-carbon-yl]-phospho-ramidic acid, (II), in water. X-ray analysis has shown that the N-P bond in (II) breaks, leading to the formation of the substituted carbamide (I). This compound exists as an inter-nal salt. The unit cell consists of a urea cation and an anion of H(2)PO(4) (-). Protonation of the N atom of the heterocyclic ring was confirmed by the location of the H atom in a difference Fourier map. The mol-ecules of substituted urea are connected by O⋯O hydrogen bonds into unlimited planes. In turn, those planes are connected to each other via N-H⋯O hydrogen bonds with mol-ecules of phospho-ric acid, forming a three-dimensional polymer.

Download full-text PDF

Source
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC3151748PMC
http://dx.doi.org/10.1107/S1600536811021337DOI Listing

Publication Analysis

Top Keywords

hydrogen bonds
8
2-ureido-13-thia-zol-3-ium dihydrogen
4
dihydrogen phosphate
4
phosphate title
4
title compound
4
compound c4h6n3os+·h2po4
4
c4h6n3os+·h2po4 result
4
result hydrolysis
4
hydrolysis [13-thia-zol-2-yl-amino-carbon-yl]-phospho-ramidic
4
[13-thia-zol-2-yl-amino-carbon-yl]-phospho-ramidic acid
4

Similar Publications

Want AI Summaries of new PubMed Abstracts delivered to your In-box?

Enter search terms and have AI summaries delivered each week - change queries or unsubscribe any time!