Geometry & MOs

Info

ID:	293853
PubChem CID:	117405956
Reduced:	ClFO4H10C11 (1)
Stoich.:	ABC4D10E11 (1)
Weight, g/mol:	260.045151
ΔH_f, kcal/mol:	-196.93
Dipole, Da:	3.94
IP(EA), eV:	-9.18(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-chloro-3,5,6-trihydroxyphenyl)-2,2-dimethylpropanoic acid

Drug info:

PubChemData

Smile

C1COC2=CC(=C(C(=C2OC1)CC(=O)O)F)Cl

DOS

IR

Vibrations