Geometry & MOs

Info

ID:	366546
PubChem CID:	127320062
Reduced:	N3O4C21H31 (1)
Stoich.:	A3B4C21D31 (1)
Weight, g/mol:	379.200825
ΔH_f, kcal/mol:	-154.41
Dipole, Da:	1.91
IP(EA), eV:	-8.38(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-5-pyridin-3-yl-4-[4-(pyridin-3-ylmethyl)piperazine-1-carbonyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CCN(CC(=O)NC1=CC2=C(C=C1)OCCO2)C(=O)C(C)N3CCCCCC3

DOS

IR

Vibrations