Geometry & MOs

Info

ID:	296565
PubChem CID:	117584450
Reduced:	ClO2N3C10H12 (1)
Stoich.:	AB2C3D10E12 (1)
Weight, g/mol:	261.124405
ΔH_f, kcal/mol:	-71.0
Dipole, Da:	4.8
IP(EA), eV:	-9.65(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-chloroacetyl)amino]-N-(1-methylpiperidin-3-yl)propanamide

Drug info:

PubChemData

Smile

C1=CN=CC=C1NC(=O)CCNC(=O)CCl

DOS

IR

Vibrations