Geometry & MOs

Info

ID:	66563
PubChem CID:	46504809
Reduced:	BrSN3O3C21H24 (1)
Stoich.:	ABC3D3E21F24 (1)
Weight, g/mol:	505.91337
ΔH_f, kcal/mol:	-61.1
Dipole, Da:	10.32
IP(EA), eV:	-8.06(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-(4-bromo-2-fluorophenyl)-1-propanoyl-2,3-dihydroindole-6-sulfonamide

Drug info:

PubChemData

Smile

CCC(=O)N1CCC2=CC(=C(C=C21)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4)Br

DOS

IR

Vibrations