Geometry & MOs

Info

ID:	293829
PubChem CID:	117404238
Reduced:	F3O3H11C12 (1)
Stoich.:	A3B3C11D12 (1)
Weight, g/mol:	260.069616
ΔH_f, kcal/mol:	-235.95
Dipole, Da:	4.35
IP(EA), eV:	-9.28(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(3-fluoro-2-hydroxy-5,6-dimethoxyphenyl)-2-hydroxyacetate

Drug info:

PubChemData

Smile

C1CC1(CC2=C(C=CC3=C2OCO3)C(F)(F)F)O

DOS

IR

Vibrations