Geometry & MOs

Info

ID:	194295
PubChem CID:	78511915
Reduced:	NO2H8C10 (2)
Stoich.:	AB2C8D10 (2)
Weight, g/mol:	391.049047
ΔH_f, kcal/mol:	-81.18
Dipole, Da:	7.02
IP(EA), eV:	-9.49(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(5,6-dichloropyridine-3-carbonyl)amino]-3-(1H-indol-3-yl)propanoate

Drug info:

PubChemData

Smile

CC1=CC(=O)OC2=C1C=CC(=C2)OC(C)C(=O)NC3=CC=CC=C3C#N

DOS

IR

Vibrations