Geometry & MOs

Info

ID:	196225
PubChem CID:	78799160
Reduced:	Cl2N2O3C15H20 (1)
Stoich.:	A2B2C3D15E20 (1)
Weight, g/mol:	379.22712
ΔH_f, kcal/mol:	-136.47
Dipole, Da:	2.45
IP(EA), eV:	-9.23(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-acetamido-N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]hexanamide

Drug info:

PubChemData

Smile

CCCN(CC(=O)NC1=C(C=C(C=C1)Cl)Cl)C(=O)COCC

DOS

IR

Vibrations