Geometry & MOs

Info

ID:	338541
PubChem CID:	127259256
Reduced:	Cl3O4H9C11 (1)
Stoich.:	A3B4C9D11 (1)
Weight, g/mol:	345.94695
ΔH_f, kcal/mol:	-168.13
Dipole, Da:	6.26
IP(EA), eV:	-9.73(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2,3-dichloro-4-[(E)-hydroxy-(3-oxothiophen-2-ylidene)methyl]phenoxy]acetic acid

Drug info:

PubChemData

Smile

CC(=O)OCCOC1=C(C(=C(C=C1)C(=O)Cl)Cl)Cl

DOS

IR

Vibrations