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1-(2-Carb-oxy-eth-yl)-3-(carboxyl-atometh-yl)-2-ethyl-benzimidazol-1-ium monohydrate.

ABSTRACT: In the title compound, C14H16N2O4·H2O, three substituent groups are located on the same side of the benzimidazole ring plane. In the crystal, O-H?O hydrogen bonds and ?-? stacking between parallel imidazole rings [centroid-centroid distance = 3.858?(4)?Å] link the mol-ecules into a three-dimensional supra-molecular structure.

SUBMITTER: Yao H

PROVIDER: S-EPMC3629598 | biostudies-literature | 2013 Apr

REPOSITORIES: biostudies-literature

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1-(2-Carb-oxy-eth-yl)-3-(carboxyl-atometh-yl)-2-ethyl-benzimidazol-1-ium monohydrate.

Yao Hong H Xie Yong-Qiang YQ Yao Xiao-Qiang XQ Yang Yun-Xia YX Zhang You-Ming YM

Acta crystallographica. Section E, Structure reports online 20130316 Pt 4

In the title compound, C14H16N2O4·H2O, three substituent groups are located on the same side of the benzimidazole ring plane. In the crystal, O-H⋯O hydrogen bonds and π-π stacking between parallel imidazole rings [centroid-centroid distance = 3.858 (4) Å] link the mol-ecules into a three-dimensional supra-molecular structure. ...[more]

PMID: 23634085

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