Geometry & MOs

Info

ID:	122639
PubChem CID:	50815624
Reduced:	N3O4C23H27 (1)
Stoich.:	A3B4C23D27 (1)
Weight, g/mol:	406.200491
ΔH_f, kcal/mol:	-122.62
Dipole, Da:	5.16
IP(EA), eV:	-8.85(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-4-methylquinoxaline-2,3-dione

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2N(C(=O)C1=O)CC3=CC=C(C=C3)C(=O)NCCCOCC

DOS

IR

Vibrations