Geometry & MOs

Info

ID:	79787
PubChem CID:	49830367
Reduced:	SO2N6H26C27 (1)
Stoich.:	AB2C6D26E27 (1)
Weight, g/mol:	387.149538
ΔH_f, kcal/mol:	29.16
Dipole, Da:	4.7
IP(EA), eV:	-8.2(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(5-aminoquinoxalin-6-yl)phenyl]-3-(2-fluoro-5-methylphenyl)urea

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)C3=CSC4=C3C(=NC=C4C5=CN(N=C5)CC(C)O)N

DOS

IR

Vibrations