Geometry & MOs

Info

ID:	143532
PubChem CID:	53222621
Reduced:	N2O2H8C13 (1)
Stoich.:	A2B2C8D13 (1)
Weight, g/mol:	247.040006
ΔH_f, kcal/mol:	6.51
Dipole, Da:	5.1
IP(EA), eV:	-10.38(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chloro-2-methylphenyl)pyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C#N)C2=CC(=NC=C2)C(=O)O

DOS

IR

Vibrations