Geometry & MOs

Info

ID:	66680
PubChem CID:	46505055
Reduced:	BrSN2O5C21H21 (1)
Stoich.:	ABC2D5E21F21 (1)
Weight, g/mol:	483.11913
ΔH_f, kcal/mol:	-116.12
Dipole, Da:	9.8
IP(EA), eV:	-8.53(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-1-(cyclopropanecarbonyl)-N-[3-(4-methylpiperidin-1-yl)propyl]-2,3-dihydroindole-6-sulfonamide

Drug info:

PubChemData

Smile

C1CC1C(=O)N2CCC3=CC(=C(C=C32)S(=O)(=O)NCC4COC5=CC=CC=C5O4)Br

DOS

IR

Vibrations