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1-[(6-Chloro-pyridin-3-yl)meth-yl]imidazolidin-2-iminium chloride.

ABSTRACT: The title compound, C(9)H(12)ClN(4) (+)·Cl(-), is a natural metabolic product of imidacloprid [systematic name: (E)-1-(6-chloro-3-pyridyl-meth-yl)-N-nitro-imidazolidin-2-yl-idene-amine] and was obtained by the reduction of the latter using Fe in HCl. The dihedral angle between the pyridine and imidazole rings is 62.09?(12)°. The crystal structure is stabilized by N-H?Cl and C-H?Cl inter-actions involving the chloride anion. The pyridine N and the chloride atoms are not involved in inter-molecular inter-actions.

SUBMITTER: Kant R 

PROVIDER: S-EPMC3254490 | biostudies-literature | 2012 Jan

REPOSITORIES: biostudies-literature

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1-[(6-Chloro-pyridin-3-yl)meth-yl]imidazolidin-2-iminium chloride.

Kant Rajni R   Gupta Vivek K VK   Kapoor Kamini K   Deshmukh Madhukar B MB   Shripanavar Chetan S CS  

Acta crystallographica. Section E, Structure reports online 20111217 Pt 1

The title compound, C(9)H(12)ClN(4) (+)·Cl(-), is a natural metabolic product of imidacloprid [systematic name: (E)-1-(6-chloro-3-pyridyl-meth-yl)-N-nitro-imidazolidin-2-yl-idene-amine] and was obtained by the reduction of the latter using Fe in HCl. The dihedral angle between the pyridine and imidazole rings is 62.09 (12)°. The crystal structure is stabilized by N-H⋯Cl and C-H⋯Cl inter-actions involving the chloride anion. The pyridine N and the chloride atoms are not involved in inter-molecula  ...[more]

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