Geometry & MOs

Info

ID:	66646
PubChem CID:	46504982
Reduced:	BrSN2O5C21H21 (1)
Stoich.:	ABC2D5E21F21 (1)
Weight, g/mol:	443.08783
ΔH_f, kcal/mol:	-143.46
Dipole, Da:	10.39
IP(EA), eV:	-8.9(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-1-(cyclopropanecarbonyl)-N-[2-(dimethylamino)ethyl]-N-ethyl-2,3-dihydroindole-6-sulfonamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(C=C3CCN(C3=C2)C(=O)C4CC4)Br

DOS

IR

Vibrations