Geometry & MOs

Info

ID:	65942
PubChem CID:	46484657
Reduced:	FSN2O5H17C19 (1)
Stoich.:	ABC2D5E17F19 (1)
Weight, g/mol:	359.091749
ΔH_f, kcal/mol:	-84.02
Dipole, Da:	7.44
IP(EA), eV:	-8.61(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-ethoxyphenyl)-5-[(2-fluoro-4-nitrophenoxy)methyl]-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)C2=NC(=CS2)COC3=C(C=C(C=C3)[N+](=O)[O-])F)OC

DOS

IR

Vibrations