Geometry & MOs

Info

ID:	329561
PubChem CID:	126738253
Reduced:	ClINO2H3C8 (1)
Stoich.:	ABCD2E3F8 (1)
Weight, g/mol:	474.153934
ΔH_f, kcal/mol:	-22.21
Dipole, Da:	4.79
IP(EA), eV:	-9.65(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(6,7-dimethoxyquinolin-4-yl)oxy-4-methylphenyl]-3-(3-nitrophenyl)urea

Drug info:

PubChemData

Smile

C1=CC(=C2C(=C1Cl)C(=O)C(=O)N2)I

DOS

IR

Vibrations