Geometry & MOs

Info

ID:	267844
PubChem CID:	103589736
Reduced:	FN2C15H23 (1)
Stoich.:	AB2C15D23 (1)
Weight, g/mol:	251.14339
ΔH_f, kcal/mol:	-57.41
Dipole, Da:	2.9
IP(EA), eV:	-8.17(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(2-amino-4-fluoro-5-methylphenyl)piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

CCN(C1CCCCC1)C2=C(C=C(C(=C2)C)F)N

DOS

IR

Vibrations