Geometry & MOs

Info

ID:	65712
PubChem CID:	46386779
Reduced:	OF4N4H14C21 (1)
Stoich.:	AB4C4D14E21 (1)
Weight, g/mol:	436.154683
ΔH_f, kcal/mol:	-149.24
Dipole, Da:	2.43
IP(EA), eV:	-8.98(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-fluoro-2-pyridin-3-yl-1H-indol-3-yl)-3-(3,4,5-trimethoxyphenyl)urea

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(F)(F)F)NC(=O)NC2=C(NC3=C2C=C(C=C3)F)C4=CN=CC=C4

DOS

IR

Vibrations