Geometry & MOs

Info

ID:	352192
PubChem CID:	127283261
Reduced:	ClO2N3C21H28 (1)
Stoich.:	AB2C3D21E28 (1)
Weight, g/mol:	396.216141
ΔH_f, kcal/mol:	-69.64
Dipole, Da:	5.37
IP(EA), eV:	-9.53(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-cyanophenoxy)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC(C1)C(C2=CC=C(C=C2)Cl)NC(=O)NC3CCN(CC3)C(=O)C4CC4

DOS

IR

Vibrations