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N,N-Dimethyl-propane-1,2-diaminium bis-(6-carb-oxy-pyridine-2-carboxyl-ate) monohydrate.

ABSTRACT: The asymmetric unit of the title proton-transfer compound, C(5)H(16)N(2) (2+)·2C(7)H(4)NO(4) (-)·H(2)O, consists of two mono-deproton-ated pyridine-2,6-dicarb-oxy-lic acid mol-ecules as anions, viz. (py-2,6-dcH)(-), one diprotonated N(1),N(1)-dimethyl-propane-1,2-diamine mol-ecule as a cation, viz. (dmpdaH(2))(2+), and one water mol-ecule. The crystal packing shows extensive O-H?O, N-H?O, N-H?N and O-H?N and weak inter-molecular C-H?O hydrogen bonds. These inter-actions link the (dmpdaH(2))(2+) cation, the (py-2,6-dcH)(-) anions and water mol-ecule and play an important role in the stabilization of crystal packing.

SUBMITTER: Aghabozorg H

PROVIDER: S-EPMC3100043 | biostudies-literature | 2011 Apr

REPOSITORIES: biostudies-literature

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N,N-Dimethyl-propane-1,2-diaminium bis-(6-carb-oxy-pyridine-2-carboxyl-ate) monohydrate.

Aghabozorg Hossein H Foroughian Mahsa M Foroumadi Alireza A Bruno Giuseppe G Amiri Rudbari Hadi H

Acta crystallographica. Section E, Structure reports online 20110319 Pt 4

The asymmetric unit of the title proton-transfer compound, C(5)H(16)N(2) (2+)·2C(7)H(4)NO(4) (-)·H(2)O, consists of two mono-deproton-ated pyridine-2,6-dicarb-oxy-lic acid mol-ecules as anions, viz. (py-2,6-dcH)(-), one diprotonated N(1),N(1)-dimethyl-propane-1,2-diamine mol-ecule as a cation, viz. (dmpdaH(2))(2+), and one water mol-ecule. The crystal packing shows extensive O-H⋯O, N-H⋯O, N-H⋯N and O-H⋯N and weak inter-molecular C-H⋯O hydrogen bonds. These inter-actions link the (dmpdaH(2))(2+) ...[more]

PMID: 21754202

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