Geometry & MOs

Info

ID:	66583
PubChem CID:	46504854
Reduced:	BrSN2O5C21H25 (1)
Stoich.:	ABC2D5E21F25 (1)
Weight, g/mol:	450.06128
ΔH_f, kcal/mol:	-159.0
Dipole, Da:	10.97
IP(EA), eV:	-8.41(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-5-bromo-N-ethyl-1-propanoyl-2,3-dihydroindole-6-sulfonamide

Drug info:

PubChemData

Smile

CCC(=O)N1CCC2=CC(=C(C=C21)S(=O)(=O)NC3=C(C=CC(=C3)OCC)OCC)Br

DOS

IR

Vibrations