Geometry & MOs

Info

ID:	20240
PubChem CID:	582787
Reduced:	N3O5C23H25 (1)
Stoich.:	A3B5C23D25 (1)
Weight, g/mol:	423.179421
ΔH_f, kcal/mol:	-161.99
Dipole, Da:	3.94
IP(EA), eV:	-8.4(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[[3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]acetate

Drug info:

PubChemData

Smile

CCOC(=O)CNC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)OCC3=CC=CC=C3

DOS

IR

Vibrations