Geometry & MOs

Info

ID:	206105
PubChem CID:	80204089
Reduced:	OF2N2C16H24 (1)
Stoich.:	AB2C2D16E24 (1)
Weight, g/mol:	267.163457
ΔH_f, kcal/mol:	-137.07
Dipole, Da:	4.3
IP(EA), eV:	-8.55(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[1-(3-fluoro-4-methylphenyl)ethylamino]-3-methylbutanoate

Drug info:

PubChemData

Smile

CC(C)N1CCN(CC1)CCC(C2=CC(=CC(=C2)F)F)O

DOS

IR

Vibrations