Geometry & MOs

Info

ID:	263194
PubChem CID:	103345015
Reduced:	OSC8H11 (2)
Stoich.:	ABC8D11 (2)
Weight, g/mol:	268.095558
ΔH_f, kcal/mol:	-81.68
Dipole, Da:	2.39
IP(EA), eV:	-8.53(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5,6-dimethyl-1,4-dithian-2-yl)-2-phenylethanol

Drug info:

PubChemData

Smile

CC1C(SC(CS1)C(=O)C2=CC=CC=C2OC(C)C)C

DOS

IR

Vibrations