Geometry & MOs

Info

ID:	121286
PubChem CID:	50762073
Reduced:	N3O3C19H19 (1)
Stoich.:	A3B3C19D19 (1)
Weight, g/mol:	355.13322
ΔH_f, kcal/mol:	-67.88
Dipole, Da:	4.75
IP(EA), eV:	-8.7(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(ethylamino)-2-oxochromen-3-yl]-3-(3-fluoro-4-methylphenyl)urea

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1NC(=O)NC2=C(C3=CC=CC=C3OC2=O)NC

DOS

IR

Vibrations