Geometry & MOs

Info

ID:	131499
PubChem CID:	51214959
Reduced:	FNO2H5C8 (2)
Stoich.:	ABC2D5E8 (2)
Weight, g/mol:	314.070285
ΔH_f, kcal/mol:	-85.51
Dipole, Da:	4.31
IP(EA), eV:	-9.41(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-fluoro-2-nitrophenoxy)methyl]-5-phenyl-1,2-oxazole

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2=CN=C(O2)COC3=C(C=CC(=C3)F)[N+](=O)[O-])F

DOS

IR

Vibrations