Geometry & MOs

Info

ID:	66598
PubChem CID:	46504879
Reduced:	BrSN3O3C17H24 (1)
Stoich.:	ABC3D3E17F24 (1)
Weight, g/mol:	479.08783
ΔH_f, kcal/mol:	-138.07
Dipole, Da:	8.9
IP(EA), eV:	-8.24(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[benzyl(methyl)amino]ethyl]-5-bromo-1-propanoyl-2,3-dihydroindole-6-sulfonamide

Drug info:

PubChemData

Smile

CCC(=O)N1CCC2=CC(=C(C=C21)S(=O)(=O)NCCN3CCCC3)Br

DOS

IR

Vibrations