Geometry & MOs

Info

ID:	353213
PubChem CID:	127284393
Reduced:	SO3N4C20H20 (1)
Stoich.:	AB3C4D20E20 (1)
Weight, g/mol:	332.148455
ΔH_f, kcal/mol:	-65.96
Dipole, Da:	7.0
IP(EA), eV:	-9.06(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[4-(1-methyl-5-oxopyrrolidine-3-carbonyl)piperazine-1-carbonyl]-1H-pyridin-2-one

Drug info:

PubChemData

Smile

CC1=C2C(=C(SC2=NC=C1)C(=O)N3CCN(CC3)C(=O)C4=CNC(=O)C=C4)C

DOS

IR

Vibrations