Geometry & MOs

Info

ID:	289385
PubChem CID:	104348631
Reduced:	ClON3C14H20 (1)
Stoich.:	ABC3D14E20 (1)
Weight, g/mol:	290.174276
ΔH_f, kcal/mol:	-42.0
Dipole, Da:	4.68
IP(EA), eV:	-9.26(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-acetamidopyrrolidin-1-yl)-N-(5-amino-2-methylphenyl)acetamide

Drug info:

PubChemData

Smile

CC(=O)NC1CCN(C1)C(CN)C2=CC(=CC=C2)Cl

DOS

IR

Vibrations