Geometry & MOs

Info

ID:	347989
PubChem CID:	127273051
Reduced:	SO3N4C18H28 (1)
Stoich.:	AB3C4D18E28 (1)
Weight, g/mol:	359.212139
ΔH_f, kcal/mol:	-105.84
Dipole, Da:	9.44
IP(EA), eV:	-8.36(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-fluoro-2,3-dimethyl-N-[2-(4-methylpiperazin-1-yl)propyl]quinoxaline-5-carboxamide

Drug info:

PubChemData

Smile

CC(CNC(=O)C1=CC=C(C=C1)N2CCCS2(=O)=O)N3CCN(CC3)C

DOS

IR

Vibrations