Geometry & MOs

Info

ID:	8138
PubChem CID:	75086
Reduced:	ClO4H5C8 (1)
Stoich.:	AB4C5D8 (1)
Weight, g/mol:	199.987636
ΔH_f, kcal/mol:	-146.57
Dipole, Da:	3.15
IP(EA), eV:	-10.67(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chlorobenzene-1,3-dicarboxylic acid

Drug info:

PubChemData

Smile

C1=C(C=C(C=C1C(=O)O)Cl)C(=O)O

DOS

IR

Vibrations