Geometry & MOs

Info

ID:	143500
PubChem CID:	53217661
Reduced:	ClNOH8C11 (1)
Stoich.:	ABCD8E11 (1)
Weight, g/mol:	215.058243
ΔH_f, kcal/mol:	-5.36
Dipole, Da:	3.86
IP(EA), eV:	-9.2(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-hydroxypyridin-2-yl)benzoic acid

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C2=CC=CNC2=O)Cl

DOS

IR

Vibrations