The crystal and molecular structures of TRANS-1,4-DICHLOROCYCLOHEXANE (cas 16890-91-8)

Add time:08/02/2019    Source:sciencedirect.com

A new phase transition in the title compound is observed at 260 K by DSC and NMR. Furthermore, the phase stable between 260 K and 280 K is found to be triclinic and not monoclinic as believed earlier. The structure is determined from single crystal X-ray data, and the molecules are found to be in the ee chair conformation. In the phase stable below 260 K the 13C CPMAS NMR spectrum shows that the molecules are in the aa chair conformation.

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