Geometry & MOs

Info

ID:	66722
PubChem CID:	46505138
Reduced:	BrSN2O5C20H21 (1)
Stoich.:	ABC2D5E20F21 (1)
Weight, g/mol:	436.04563
ΔH_f, kcal/mol:	-169.49
Dipole, Da:	10.86
IP(EA), eV:	-8.98(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-acetyl-5-bromo-2-methyl-N-(2-phenylethyl)-2,3-dihydroindole-6-sulfonamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(C=C3CC(N(C3=C2)C(=O)C)C)Br

DOS

IR

Vibrations