Geometry & MOs

Info

ID:	371804
PubChem CID:	131271729
Reduced:	FIO3H6C8 (1)
Stoich.:	ABC3D6E8 (1)
Weight, g/mol:	295.93457
ΔH_f, kcal/mol:	-140.4
Dipole, Da:	0.53
IP(EA), eV:	-9.47(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-fluoro-2-hydroxy-6-iodobenzoate

Drug info:

PubChemData

Smile

COC(=O)C1=C(C=CC(=C1F)I)O

DOS

IR

Vibrations