Geometry & MOs

Info

ID:	292680
PubChem CID:	117356928
Reduced:	F2N2O3H8C10 (1)
Stoich.:	A2B2C3D8E10 (1)
Weight, g/mol:	242.059052
ΔH_f, kcal/mol:	-115.15
Dipole, Da:	8.78
IP(EA), eV:	-8.22(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(2-fluoro-3-hydroxy-5-methoxyphenyl)-2-oxoacetate

Drug info:

PubChemData

Smile

COC1=CC(=C(/C(=C\2/C=C(NO2)N)/C1=O)F)F

DOS

IR

Vibrations