Geometry & MOs

Info

ID:	66552
PubChem CID:	46504785
Reduced:	BrSN2O3C19H21 (1)
Stoich.:	ABC2D3E19F21 (1)
Weight, g/mol:	448.04563
ΔH_f, kcal/mol:	-82.68
Dipole, Da:	8.74
IP(EA), eV:	-8.8(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-phenyl-1-propanoyl-N-prop-2-enyl-2,3-dihydroindole-6-sulfonamide

Drug info:

PubChemData

Smile

CCC(=O)N1CCC2=CC(=C(C=C21)S(=O)(=O)NCCC3=CC=CC=C3)Br

DOS

IR

Vibrations