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1-Diphenyl-methyl-4-[3-(4-fluoro-benzo-yl)prop-yl]piperazine-1,4-diium dichloride monohydrate.

ABSTRACT: In the title compound, C(27)H(31)FN(2)O(2+)·2Cl(-)·H(2)O, the piperazine ring adopts a chair conformation and both N atoms are protonated. The Cl(-) anions form strong hydrogen bonds to these protons. O/N-H?Cl and C-H?O hydrogen bonds link the anions, cations and water of hydration into a three-dimensional network.

SUBMITTER: Wang J

PROVIDER: S-EPMC3201513 | biostudies-other | 2011 Oct

REPOSITORIES: biostudies-other

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1-Diphenyl-methyl-4-[3-(4-fluoro-benzo-yl)prop-yl]piperazine-1,4-diium dichloride monohydrate.

Wang Jing J Wang Yongli Y Yang Caiqin C

Acta crystallographica. Section E, Structure reports online 20110930 Pt 10

In the title compound, C(27)H(31)FN(2)O(2+)·2Cl(-)·H(2)O, the piperazine ring adopts a chair conformation and both N atoms are protonated. The Cl(-) anions form strong hydrogen bonds to these protons. O/N-H⋯Cl and C-H⋯O hydrogen bonds link the anions, cations and water of hydration into a three-dimensional network. ...[more]

PMID: 22058796

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