Bis(adeninium) chloranilate dihydrate

Kazuma Gotoh; Rie Ishikawa; Hiroyuki Ishida

doi:10.1107/S1600536807052087

Bis(adeninium) chloranilate dihydrate

Kazuma Gotoh, Rie Ishikawa, Hiroyuki Ishida

Research output: Contribution to journal › Article › peer-review

4 Citations (Scopus)

Abstract

In the crystal structure of the title compound, 2C5H6N5 ⁺·C6Cl2O4 ^2-·2H2O, two adeninium cations, one chloranilate dianion and two water mol-ecules are held together by O - H⋯O, N - H⋯O, O - H⋯Cl and C - H⋯O hydrogen bonds, forming a centrosymmetric unit. The chloranilate dianion resides on an inversion centre. The anion and two cations are approximately coplanar, the dihedral angle between the planes of the adeninium cation and the chloranilate dianion being 3.25 (3)°. The crystal structure is stabilized by inter-unit N - H⋯N, N - H⋯O, N - H⋯Cl and O - H⋯N hydrogen bonds, forming a three-dimensional hydrogen-bonding network.

Original language	English
Pages (from-to)	o4433
Journal	Acta Crystallographica Section E: Structure Reports Online
Volume	63
Issue number	11
DOIs	https://doi.org/10.1107/S1600536807052087
Publication status	Published - Oct 5 2007

ASJC Scopus subject areas

Chemistry(all)
Materials Science(all)
Condensed Matter Physics

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title = "Bis(adeninium) chloranilate dihydrate",

abstract = "In the crystal structure of the title compound, 2C5H6N5 +·C6Cl2O4 2-·2H2O, two adeninium cations, one chloranilate dianion and two water mol-ecules are held together by O - H⋯O, N - H⋯O, O - H⋯Cl and C - H⋯O hydrogen bonds, forming a centrosymmetric unit. The chloranilate dianion resides on an inversion centre. The anion and two cations are approximately coplanar, the dihedral angle between the planes of the adeninium cation and the chloranilate dianion being 3.25 (3)°. The crystal structure is stabilized by inter-unit N - H⋯N, N - H⋯O, N - H⋯Cl and O - H⋯N hydrogen bonds, forming a three-dimensional hydrogen-bonding network.",

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T1 - Bis(adeninium) chloranilate dihydrate

AU - Gotoh, Kazuma

AU - Ishikawa, Rie

AU - Ishida, Hiroyuki

PY - 2007/10/5

Y1 - 2007/10/5

N2 - In the crystal structure of the title compound, 2C5H6N5 +·C6Cl2O4 2-·2H2O, two adeninium cations, one chloranilate dianion and two water mol-ecules are held together by O - H⋯O, N - H⋯O, O - H⋯Cl and C - H⋯O hydrogen bonds, forming a centrosymmetric unit. The chloranilate dianion resides on an inversion centre. The anion and two cations are approximately coplanar, the dihedral angle between the planes of the adeninium cation and the chloranilate dianion being 3.25 (3)°. The crystal structure is stabilized by inter-unit N - H⋯N, N - H⋯O, N - H⋯Cl and O - H⋯N hydrogen bonds, forming a three-dimensional hydrogen-bonding network.

AB - In the crystal structure of the title compound, 2C5H6N5 +·C6Cl2O4 2-·2H2O, two adeninium cations, one chloranilate dianion and two water mol-ecules are held together by O - H⋯O, N - H⋯O, O - H⋯Cl and C - H⋯O hydrogen bonds, forming a centrosymmetric unit. The chloranilate dianion resides on an inversion centre. The anion and two cations are approximately coplanar, the dihedral angle between the planes of the adeninium cation and the chloranilate dianion being 3.25 (3)°. The crystal structure is stabilized by inter-unit N - H⋯N, N - H⋯O, N - H⋯Cl and O - H⋯N hydrogen bonds, forming a three-dimensional hydrogen-bonding network.

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Bis(adeninium) chloranilate dihydrate

Abstract

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