Geometry & MOs

Info

ID:	24880
PubChem CID:	614215
Reduced:	S3H8C10 (1)
Stoich.:	A3B8C10 (1)
Weight, g/mol:	223.978814
ΔH_f, kcal/mol:	68.05
Dipole, Da:	4.41
IP(EA), eV:	-8.55(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-5-phenyl-1,3-dithiole-2-thione

Drug info:

PubChemData

Smile

CC1=C(SC(=S)S1)C2=CC=CC=C2

DOS

IR

Vibrations