Geometry & MOs

Info

ID:	258564
PubChem CID:	103154989
Reduced:	Cl2N2O2C13H18 (1)
Stoich.:	A2B2C2D13E18 (1)
Weight, g/mol:	268.158706
ΔH_f, kcal/mol:	-83.82
Dipole, Da:	4.65
IP(EA), eV:	-9.3(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-[1-(4-fluorophenyl)ethyl]-3-methoxy-N-methylbutanamide

Drug info:

PubChemData

Smile

CN(CC1=CC(=C(C=C1)Cl)Cl)C(=O)CC(CN)OC

DOS

IR

Vibrations