Geometry & MOs

Info

ID:	414002
PubChem CID:	135086955
Reduced:	PN2O3C15H21 (1)
Stoich.:	AB2C3D15E21 (1)
Weight, g/mol:	262.131742
ΔH_f, kcal/mol:	-163.06
Dipole, Da:	2.08
IP(EA), eV:	-8.35(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-amino-3-(5-methoxy-1H-indol-3-yl)butanoate

Drug info:

PubChemData

Smile

CCOP(=O)(C1CC2=C(CN1)NC3=CC=CC=C23)OCC

DOS

IR

Vibrations