Geometry & MOs

Info

ID:	441566
PubChem CID:	135236247
Reduced:	FSN3O3H24C25 (1)
Stoich.:	ABC3D3E24F25 (1)
Weight, g/mol:	573.07332
ΔH_f, kcal/mol:	-93.96
Dipole, Da:	2.83
IP(EA), eV:	-8.55(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-bromo-5-[2-(4-fluorophenyl)propan-2-yl]phenyl]-6-(methanesulfonamido)-5-methoxyindole-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C1=CC(=CC=C1)N2C(=CC3=C2C=C(C=C3)NS(=O)(=O)C)C(=O)N)C4=CC=CC=C4F

DOS

IR

Vibrations