Geometry & MOs

Info

ID:	65750
PubChem CID:	46386824
Reduced:	FO2N4H19C22 (1)
Stoich.:	AB2C4D19E22 (1)
Weight, g/mol:	424.0335
ΔH_f, kcal/mol:	-32.13
Dipole, Da:	3.54
IP(EA), eV:	-8.41(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1NC(=O)NC2=C(NC3=C2C=C(C=C3)F)C4=CC=NC=C4

DOS

IR

Vibrations