Geometry & MOs

Info

ID:	69816
PubChem CID:	47205441
Reduced:	N2S2O3C13H18 (1)
Stoich.:	A2B2C3D13E18 (1)
Weight, g/mol:	294.103814
ΔH_f, kcal/mol:	-93.87
Dipole, Da:	3.05
IP(EA), eV:	-9.64(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(1H-indol-3-yl)ethyl]-2-methylsulfonylpropanamide

Drug info:

PubChemData

Smile

C1CC(C=C1)CC(=O)NCCC2=CC=C(S2)S(=O)(=O)N

DOS

IR

Vibrations