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3,14-Diethyl-2,13-di-aza-6,17-diazonia-tri-cyclo-[16.4.0.0(7,12)]docosane dichloride tetra-hydrate from synchrotron radiation.

ABSTRACT: The asymmetric unit of title hydrated salt, C22H46N4 (2+)·2Cl(-)·4H2O, comprises half a centrosymmetric dication, one Cl(-) anion and two water mol-ecules of crystallization. The structure determination reveals that protonation has occurred at diagonally opposite amine N atoms, and that the dication features intra-molecular N-H?N hydrogen bonds. In the crystal, a three-dimensional artchitecture is formed by O-H?Cl/N and N-H?Cl/O hydrogen bonds.

SUBMITTER: Moon D

PROVIDER: S-EPMC3884294 | biostudies-literature | 2013 Oct

REPOSITORIES: biostudies-literature

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3,14-Diethyl-2,13-di-aza-6,17-diazonia-tri-cyclo-[16.4.0.0(7,12)]docosane dichloride tetra-hydrate from synchrotron radiation.

Moon Dohyun D Subhan Md Abdus MA Choi Jong-Ha JH

Acta crystallographica. Section E, Structure reports online 20131009 Pt 11

The asymmetric unit of title hydrated salt, C22H46N4 (2+)·2Cl(-)·4H2O, comprises half a centrosymmetric dication, one Cl(-) anion and two water mol-ecules of crystallization. The structure determination reveals that protonation has occurred at diagonally opposite amine N atoms, and that the dication features intra-molecular N-H⋯N hydrogen bonds. In the crystal, a three-dimensional artchitecture is formed by O-H⋯Cl/N and N-H⋯Cl/O hydrogen bonds. ...[more]

PMID: 24454070

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