Geometry & MOs

Info

ID:	20591
PubChem CID:	584738
Reduced:	Cl2O3H10C14 (1)
Stoich.:	A2B3C10D14 (1)
Weight, g/mol:	296.0007
ΔH_f, kcal/mol:	-89.74
Dipole, Da:	5.44
IP(EA), eV:	-9.38(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2,5-dichlorophenoxy)methyl]benzoic acid

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)C(=O)O)COC2=C(C=CC(=C2)Cl)Cl

DOS

IR

Vibrations