6533b871fe1ef96bd12d1a19
RESEARCH PRODUCT
rac-1,1,1,6,6,6-Hexachlorohex-3-yne-2,5-diol hemihydrate
Dieter SchollmeyerHeiner Detertsubject
chemistry.chemical_classificationcrystal structurecentrosymmetric dimer010405 organic chemistryChemistryStereochemistryHydrogen bondHemihydrateDiolAlkynelayer structureCrystal structure010402 general chemistryHEXA01 natural sciences0104 chemical sciencesorganochlorine compoundCrystalCrystallographychemistry.chemical_compoundlcsh:QD901-999alkyneMoleculelcsh:Crystallographydescription
The asymmetric unit of the title compound, C6H4Cl6O2·0.5H2O, contains one molecule of 1,1,1,6,6,6-hexachlorohex-3-yne-2,5-diol and half a water molecule located on a twofold rotation axis. In the crystal, pairs of hexachlorohexynediol molecules form centrosymmetric dimers connectedviapairwise O—H...O hydrogen bonds. These dimers are connected by water molecules, resulting in layers parallel to theabplane.
| year | journal | country | edition | language |
|---|---|---|---|---|
| 2017-08-28 | IUCrData |