Geometry & MOs

Info

ID:	65702
PubChem CID:	46386768
Reduced:	ClFON4H14C20 (1)
Stoich.:	ABCD4E14F20 (1)
Weight, g/mol:	406.144119
ΔH_f, kcal/mol:	4.37
Dipole, Da:	7.85
IP(EA), eV:	-8.62(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,5-dimethoxyphenyl)-3-(5-fluoro-2-pyridin-3-yl-1H-indol-3-yl)urea

Drug info:

PubChemData

Smile

C1=CC(=CN=C1)C2=C(C3=C(N2)C=CC(=C3)F)NC(=O)NC4=CC=C(C=C4)Cl

DOS

IR

Vibrations