6533b7d7fe1ef96bd1267c69

RESEARCH PRODUCT

N,N-Dimethyl-N-propylpropan-1-aminium chloride monohydrate

Jussi ValkonenManu LahtinenMinna Kärnä

subject

röntgendiffraktioCrystallographyIon exchangeChemistryHydrogen bondGeneral ChemistryCrystal structurekvaternäärinen ammoniumkloridiCondensed Matter Physicscomputer.software_genreChlorideOrganic PapersCrystallographyQD901-999medicineGeneral Materials ScienceData miningquaternary ammonium chloridecomputersingle crystal diffractionmedicine.drug

description

The title compound, C8H20N+·Cl−·H2O, has been prepared by a simple one-pot synthesis route followed by anion exchange using resin. In the crystal structure, the cations are packed in such a way that channels exist parallel to the b axis. These channels are filled by the anions and water molecules, which interact via O—H...Cl hydrogen bonds [O...Cl = 3.285 (3) and 3.239 (3) Å] to form helical chains. The cations are involved in weak intermolecular C—H...Cl and C—H...O hydrogen bonds. The title compound is not isomorphous with the bromo or iodo analogues.

http://urn.fi/URN:NBN:fi:jyu-201612135068