Geometry & MOs

Info

ID:	2100
PubChem CID:	5811
Reduced:	Cl2O2H4C7 (1)
Stoich.:	A2B2C4D7 (1)
Weight, g/mol:	189.958835
ΔH_f, kcal/mol:	-75.39
Dipole, Da:	3.72
IP(EA), eV:	-10.27(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dichlorobenzoic acid

Drug info:

PubChemData

Smile

C1=C(C=C(C=C1Cl)Cl)C(=O)O

DOS

IR

Vibrations