Geometry & MOs

Info

ID:	77306
PubChem CID:	48426041
Reduced:	ClN2O2C16H23 (1)
Stoich.:	AB2C2D16E23 (1)
Weight, g/mol:	296.129156
ΔH_f, kcal/mol:	-109.23
Dipole, Da:	3.28
IP(EA), eV:	-9.23(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-chlorophenyl)-N-[2-(diethylamino)-2-oxoethyl]propanamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)CCC1=CC(=C(C=C1)C)Cl

DOS

IR

Vibrations