Geometry & MOs

Info

ID:	441556
PubChem CID:	135236132
Reduced:	SF3O3N4H17C24 (1)
Stoich.:	AB3C3D4E17F24 (1)
Weight, g/mol:	459.086447
ΔH_f, kcal/mol:	-163.25
Dipole, Da:	7.64
IP(EA), eV:	-8.78(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(2,4-difluorophenyl)-5-fluorophenyl]-6-(methanesulfonamido)indole-2-carboxamide

Drug info:

PubChemData

Smile

CS(=O)(=O)NC1=CC2=C(C=C1)C=C(N2C3=CC=CC(=C3)C4=C(C=C(C=C4)C#N)C(F)(F)F)C(=O)N

DOS

IR

Vibrations