Geometry & MOs

Info

ID:	66301
PubChem CID:	46504158
Reduced:	BrSN4O4C24H31 (1)
Stoich.:	ABC4D4E24F31 (1)
Weight, g/mol:	441.97535
ΔH_f, kcal/mol:	-109.02
Dipole, Da:	9.74
IP(EA), eV:	-7.68(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(=O)N1CCC2=C1C(=CC(=C2)Br)S(=O)(=O)NCCCN3CCN(CC3)C4=CC=C(C=C4)OC

DOS

IR

Vibrations