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N,N-Diethyl-2-hy-droxy-ethanaminium 5-(5-chloro-2,4-dinitro-phen-yl)-2,6-dioxo-1,2,3,6-tetra-hydro-pyrimidin-4-olate hemihydrate.

ABSTRACT: The asymmetric unit of the title salt, C(6)H(16)NO(+)·C(10)H(4)ClN(4)O(7) (-)·0.5H(2)O, contains two cations, two anions and one water mol-ecule. In one independent anion, one nitro group is rotationally disordered over two orientations in a 0.657?(8):0.343?(8) ratio. In the crystal, inter-molecular N-H?O and O-H?O hydrogen bonds link all the components into ribbons extending along [100].

SUBMITTER: Babykala R

PROVIDER: S-EPMC3275279 | biostudies-other | 2012 Feb

REPOSITORIES: biostudies-other

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N,N-Diethyl-2-hy-droxy-ethanaminium 5-(5-chloro-2,4-dinitro-phen-yl)-2,6-dioxo-1,2,3,6-tetra-hydro-pyrimidin-4-olate hemihydrate.

Babykala Rajamanickam R Kalaivani Doraisamyraja D

Acta crystallographica. Section E, Structure reports online 20120131 Pt 2

The asymmetric unit of the title salt, C(6)H(16)NO(+)·C(10)H(4)ClN(4)O(7) (-)·0.5H(2)O, contains two cations, two anions and one water mol-ecule. In one independent anion, one nitro group is rotationally disordered over two orientations in a 0.657 (8):0.343 (8) ratio. In the crystal, inter-molecular N-H⋯O and O-H⋯O hydrogen bonds link all the components into ribbons extending along [100]. ...[more]

PMID: 22347135

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N,N-Diethyl-anilinium 5-(2,4-dinitro-phen-yl)-2,6-dioxo-1,2,3,6-tetra-hydro-pyrimidin-4-olate.

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N,N-Diethyl-anilinium 2,4-dioxo-5-(2,4,6-trinitro-phen-yl)-1,2,3,4-tetra-hydro-pyrimi-din-6-olate.

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