Geometry & MOs

Info

ID:	66298
PubChem CID:	46504154
Reduced:	BrSN3O3C19H28 (1)
Stoich.:	ABC3D3E19F28 (1)
Weight, g/mol:	461.98606
ΔH_f, kcal/mol:	-109.9
Dipole, Da:	10.04
IP(EA), eV:	-8.39(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-acetyl-5-bromo-N-[3-(trifluoromethyl)phenyl]-2,3-dihydroindole-6-sulfonamide

Drug info:

PubChemData

Smile

CC1CCCN(C1)CCCNS(=O)(=O)C2=C(C=C3CCN(C3=C2)C(=O)C)Br

DOS

IR

Vibrations