Geometry & MOs

Info

ID:	194302
PubChem CID:	78512329
Reduced:	N2O3C17H18 (1)
Stoich.:	A2B3C17D18 (1)
Weight, g/mol:	382.152872
ΔH_f, kcal/mol:	-1.75
Dipole, Da:	10.03
IP(EA), eV:	-9.13(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(1H-indol-3-yl)-2-[[2-(4-methoxyphenoxy)acetyl]amino]propanoate

Drug info:

PubChemData

Smile

CCCC(C1=CC=CC=C1)NC=C2C=C(C=CC2=O)[N+](=O)[O-]

DOS

IR

Vibrations