Geometry & MOs

Info

ID:	79310
PubChem CID:	49747977
Reduced:	ON2Cl3C17H17 (1)
Stoich.:	AB2C3D17E17 (1)
Weight, g/mol:	291.11384
ΔH_f, kcal/mol:	-19.61
Dipole, Da:	4.67
IP(EA), eV:	-9.34(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-1-cyanocyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CN(C)C(CNC(=O)C1=CC(=CC(=C1)Cl)Cl)C2=CC=CC=C2Cl

DOS

IR

Vibrations