Geometry & MOs

Info

ID:	66570
PubChem CID:	46504820
Reduced:	BrSN3O4C18H26 (1)
Stoich.:	ABC3D4E18F26 (1)
Weight, g/mol:	501.93844
ΔH_f, kcal/mol:	-140.26
Dipole, Da:	4.16
IP(EA), eV:	-8.89(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(=O)N1CCC2=CC(=C(C=C21)S(=O)(=O)NCCCN3CCOCC3)Br

DOS

IR

Vibrations