Geometry & MOs

Info

ID:	53099
PubChem CID:	14709570
Reduced:	OSC4H7 (2)
Stoich.:	ABC4D7 (2)
Weight, g/mol:	264.049001
ΔH_f, kcal/mol:	-82.51
Dipole, Da:	3.37
IP(EA), eV:	-8.85(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 2-(4-methylsulfanyl-4-sulfanylidenebutan-2-yl)propanedioate

Drug info:

PubChemData

Smile

CC(CC(=O)OC)CC(=S)SC

DOS

IR

Vibrations