(R,S)-3-Carboxy-2-(isoquinolinium-2-yl)propanoate monohydrate
Vladimir Stilinović, Leo Frkanec, Branko Kaitner
Acta Crystallographica Section E · 2010
doi:10.1107/s1600536810018428 (opens in a new tab)
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Abstract
The title compound, C13H11NO4·H2O, is a monohydrate of a betaine exhibiting a positively charged N-substituted isoquinoline group and a deprotonated carboxyl group. In the crystal, molecules are connected via short O—H...O hydrogen bonds between protonated and deprotonated carboxyl groups into chains of either R or S enantiomers along [001]. These chains are additionally connected by hydrogen bonding between water molecules and the deprotonated carboxy groups of neighbouring molecules.
Abstract licence: CC BY
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