Geometry & MOs

Info

ID:	440209
PubChem CID:	135230119
Reduced:	NOSC6H9 (2)
Stoich.:	ABCD6E9 (2)
Weight, g/mol:	187.0667
ΔH_f, kcal/mol:	8.9
Dipole, Da:	4.06
IP(EA), eV:	-9.1(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methylsulfanyl-3-propan-2-ylpyrrolidine-2,5-dione

Drug info:

PubChemData

Smile

CC(C)C(C)SSC1=NC=CC(C=C1)(C)[N+](=O)[O-]

DOS

IR

Vibrations