Geometry & MOs

Info

ID:	195607
PubChem CID:	78710201
Reduced:	N3O4H17C20 (1)
Stoich.:	A3B4C17D20 (1)
Weight, g/mol:	424.199822
ΔH_f, kcal/mol:	-84.8
Dipole, Da:	2.7
IP(EA), eV:	-9.89(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-(2-methoxyphenyl)ethylamino]-2-oxoethyl] 1-(2-ethylphenyl)-5-oxopyrrolidine-3-carboxylate

Drug info:

PubChemData

Smile

CC1(C(=O)N(C(=O)N1)CC(=O)OCC2=CC=CC=C2C#N)C3=CC=CC=C3

DOS

IR

Vibrations