Geometry & MOs

Info

ID:	37215
PubChem CID:	8018341
Reduced:	FNO3H12C16 (1)
Stoich.:	ABC3D12E16 (1)
Weight, g/mol:	363.07543
ΔH_f, kcal/mol:	-83.07
Dipole, Da:	3.08
IP(EA), eV:	-9.41(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-O-[2-(2-fluorophenoxy)ethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)OCCOC(=O)C2=CC=C(C=C2)C#N)F

DOS

IR

Vibrations