Geometry & MOs

Info

ID:	143005
PubChem CID:	53131461
Reduced:	SO2N4C19H20 (1)
Stoich.:	AB2C4D19E20 (1)
Weight, g/mol:	366.149204
ΔH_f, kcal/mol:	-10.09
Dipole, Da:	5.48
IP(EA), eV:	-8.57(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(4-fluorobenzoyl)piperazin-1-yl]-1-methylquinoxalin-2-one

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N(C3=O)C

DOS

IR

Vibrations