Geometry & MOs

Info

ID:	33695
PubChem CID:	7887528
Reduced:	FNCl2O4H12C16 (1)
Stoich.:	ABC2D4E12F16 (1)
Weight, g/mol:	347.116901
ΔH_f, kcal/mol:	-183.78
Dipole, Da:	7.13
IP(EA), eV:	-9.05(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2-ethoxyanilino)-2-oxoethyl] 2-fluoro-4-methoxybenzoate

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)C(=O)OCC(=O)NC2=C(C=CC(=C2)Cl)Cl)F

DOS

IR

Vibrations