Geometry & MOs

Info

ID:	66617
PubChem CID:	46504917
Reduced:	BrSN2O3C23H29 (1)
Stoich.:	ABC2D3E23F29 (1)
Weight, g/mol:	480.03546
ΔH_f, kcal/mol:	-96.02
Dipole, Da:	9.77
IP(EA), eV:	-8.83(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-1-(cyclopropanecarbonyl)-N-(3,4-dimethoxyphenyl)-2,3-dihydroindole-6-sulfonamide

Drug info:

PubChemData

Smile

CCCN(C1=CC=C(C=C1)C(C)C)S(=O)(=O)C2=C(C=C3CCN(C3=C2)C(=O)CC)Br

DOS

IR

Vibrations