Geometry & MOs

Info

ID:	298459
PubChem CID:	117649958
Reduced:	S2O4C11H18 (1)
Stoich.:	A2B4C11D18 (1)
Weight, g/mol:	376.112664
ΔH_f, kcal/mol:	-165.27
Dipole, Da:	3.19
IP(EA), eV:	-8.85(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methylsulfanylpropanoylamino)propyl 3-(3-methylsulfanyl-2,5-dioxopyrrolidin-1-yl)propanoate

Drug info:

PubChemData

Smile

CSCCC(=O)OCC(=C)OC(=O)CCSC

DOS

IR

Vibrations