Geometry & MOs

Info

ID:	387559
PubChem CID:	134985857
Reduced:	SO2C7H10 (1)
Stoich.:	AB2C7D10 (1)
Weight, g/mol:	226.048607
ΔH_f, kcal/mol:	-78.15
Dipole, Da:	3.05
IP(EA), eV:	-9.17(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dithiolan-2-yl-(4-methylphenyl)methanol

Drug info:

PubChemData

Smile

CC1CC(C(=O)O1)C(=S)C

DOS

IR

Vibrations