Cytosinium hydrogen chloranilate monohydrate

Research output: Contribution to journalArticle

10 Citations (Scopus)

Abstract

The title compound, C4H6N3O +·C6HCl2O4 -·H2O, is a monohydrate salt of chloranilic acid (2,5-dichloro-3,6-dihydroxy-1,4-benzoquinone) with cytosine [4-aminopyrimidine- 2(1H)-one]. In the crystal structure, the cytosinium cation, the hydrogen chloranilate anion and the water molecule are held together through O-H⋯O, N-H⋯O, N-H⋯Cl and C-H⋯O hydrogen bonds, forming a molecular tape. The tapes are further linked by O-H⋯Cl and C-H⋯Cl hydrogen bonds, forming a three-dimensional hydrogen-bond network.

Original languageEnglish
JournalActa Crystallographica Section E: Structure Reports Online
Volume62
Issue number10
DOIs
Publication statusPublished - Oct 2006

Fingerprint

Hydrogen
Hydrogen bonds
hydrogen bonds
Tapes
tapes
hydrogen
Cytosine
quinones
Anions
Cations
Negative ions
Salts
Crystal structure
Positive ions
anions
salts
cations
acids
crystal structure
Molecules

ASJC Scopus subject areas

  • Condensed Matter Physics
  • Structural Biology

Cite this

Cytosinium hydrogen chloranilate monohydrate. / Gotoh, Kazuma; Ishikawa, Rie; Ishida, Hiroyuki.

In: Acta Crystallographica Section E: Structure Reports Online, Vol. 62, No. 10, 10.2006.

Research output: Contribution to journalArticle

@article{668ebc13f7664ab4921b44eff00e07dd,
title = "Cytosinium hydrogen chloranilate monohydrate",
abstract = "The title compound, C4H6N3O +·C6HCl2O4 -·H2O, is a monohydrate salt of chloranilic acid (2,5-dichloro-3,6-dihydroxy-1,4-benzoquinone) with cytosine [4-aminopyrimidine- 2(1H)-one]. In the crystal structure, the cytosinium cation, the hydrogen chloranilate anion and the water molecule are held together through O-H⋯O, N-H⋯O, N-H⋯Cl and C-H⋯O hydrogen bonds, forming a molecular tape. The tapes are further linked by O-H⋯Cl and C-H⋯Cl hydrogen bonds, forming a three-dimensional hydrogen-bond network.",
author = "Kazuma Gotoh and Rie Ishikawa and Hiroyuki Ishida",
year = "2006",
month = "10",
doi = "10.1107/S1600536806038943",
language = "English",
volume = "62",
journal = "Acta Crystallographica Section E: Structure Reports Online",
issn = "1600-5368",
publisher = "International Union of Crystallography",
number = "10",

}

TY - JOUR

T1 - Cytosinium hydrogen chloranilate monohydrate

AU - Gotoh, Kazuma

AU - Ishikawa, Rie

AU - Ishida, Hiroyuki

PY - 2006/10

Y1 - 2006/10

N2 - The title compound, C4H6N3O +·C6HCl2O4 -·H2O, is a monohydrate salt of chloranilic acid (2,5-dichloro-3,6-dihydroxy-1,4-benzoquinone) with cytosine [4-aminopyrimidine- 2(1H)-one]. In the crystal structure, the cytosinium cation, the hydrogen chloranilate anion and the water molecule are held together through O-H⋯O, N-H⋯O, N-H⋯Cl and C-H⋯O hydrogen bonds, forming a molecular tape. The tapes are further linked by O-H⋯Cl and C-H⋯Cl hydrogen bonds, forming a three-dimensional hydrogen-bond network.

AB - The title compound, C4H6N3O +·C6HCl2O4 -·H2O, is a monohydrate salt of chloranilic acid (2,5-dichloro-3,6-dihydroxy-1,4-benzoquinone) with cytosine [4-aminopyrimidine- 2(1H)-one]. In the crystal structure, the cytosinium cation, the hydrogen chloranilate anion and the water molecule are held together through O-H⋯O, N-H⋯O, N-H⋯Cl and C-H⋯O hydrogen bonds, forming a molecular tape. The tapes are further linked by O-H⋯Cl and C-H⋯Cl hydrogen bonds, forming a three-dimensional hydrogen-bond network.

UR - http://www.scopus.com/inward/record.url?scp=33750010085&partnerID=8YFLogxK

UR - http://www.scopus.com/inward/citedby.url?scp=33750010085&partnerID=8YFLogxK

U2 - 10.1107/S1600536806038943

DO - 10.1107/S1600536806038943

M3 - Article

AN - SCOPUS:33750010085

VL - 62

JO - Acta Crystallographica Section E: Structure Reports Online

JF - Acta Crystallographica Section E: Structure Reports Online

SN - 1600-5368

IS - 10

ER -