Geometry & MOs

Info

ID:	65668
PubChem CID:	46386733
Reduced:	OF2N4H14C20 (1)
Stoich.:	AB2C4D14E20 (1)
Weight, g/mol:	388.153541
ΔH_f, kcal/mol:	-29.27
Dipole, Da:	2.4
IP(EA), eV:	-8.38(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4-dimethoxyphenyl)-3-(2-pyridin-3-yl-1H-indol-3-yl)urea

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=C(N2)C3=CN=CC=C3)NC(=O)NC4=C(C=CC(=C4)F)F

DOS

IR

Vibrations