Geometry & MOs

Info

ID:	287239
PubChem CID:	104234147
Reduced:	FO2N3C12H14 (1)
Stoich.:	AB2C3D12E14 (1)
Weight, g/mol:	237.091355
ΔH_f, kcal/mol:	-40.92
Dipole, Da:	5.02
IP(EA), eV:	-9.53(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-fluoro-4-(1,2,4-oxadiazol-3-ylmethoxy)phenyl]ethanamine

Drug info:

PubChemData

Smile

CC1=NOC(=N1)COC2=C(C=C(C=C2)C(C)N)F

DOS

IR

Vibrations