Geometry & MOs

Info

ID:	258634
PubChem CID:	103155817
Reduced:	O2N3C11H19 (1)
Stoich.:	A2B3C11D19 (1)
Weight, g/mol:	268.158706
ΔH_f, kcal/mol:	-80.61
Dipole, Da:	3.32
IP(EA), eV:	-9.78(0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-[1-(4-fluorophenyl)propan-2-yl]-3-methoxybutanamide

Drug info:

PubChemData

Smile

COC(CC(=O)NC1CCCC1C#N)CN

DOS

IR

Vibrations