Geometry & MOs

Info

ID:	287232
PubChem CID:	104234131
Reduced:	FON4C12H15 (1)
Stoich.:	ABC4D12E15 (1)
Weight, g/mol:	276.127406
ΔH_f, kcal/mol:	-14.96
Dipole, Da:	5.09
IP(EA), eV:	-9.3(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-(1-aminoethyl)-2-fluorophenoxy]ethyl]pyridin-2-one

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)OCC2=NN=CN2C)F)N

DOS

IR

Vibrations