Geometry & MOs

Info

ID:	20226
PubChem CID:	582733
Reduced:	N2O3C15H18 (1)
Stoich.:	A2B3C15D18 (1)
Weight, g/mol:	274.131742
ΔH_f, kcal/mol:	-111.87
Dipole, Da:	3.28
IP(EA), eV:	-8.81(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1H-indol-3-yl)-2-(2-methylpropanoylamino)propanoic acid

Drug info:

PubChemData

Smile

CC(C)C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O

DOS

IR

Vibrations