Geometry & MOs

Info

ID:	143561
PubChem CID:	53227687
Reduced:	O2Cl3H7C13 (1)
Stoich.:	A2B3C7D13 (1)
Weight, g/mol:	291.029835
ΔH_f, kcal/mol:	-62.44
Dipole, Da:	3.71
IP(EA), eV:	-9.84(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-carbamoyl-4-chlorophenyl)-5-hydroxybenzoic acid

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C(=O)O)C2=C(C=C(C=C2)Cl)Cl)Cl

DOS

IR

Vibrations