Geometry & MOs

Info

ID:	122642
PubChem CID:	50815686
Reduced:	ClO3N4C24H25 (1)
Stoich.:	AB3C4D24E25 (1)
Weight, g/mol:	410.175419
ΔH_f, kcal/mol:	-53.48
Dipole, Da:	7.67
IP(EA), eV:	-8.31(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C=CCN1C2=CC=CC=C2N(C(=O)C1=O)CCC(=O)N3CCN(CC3)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations