Geometry & MOs

Info

ID:	292324
PubChem CID:	114916775
Reduced:	ClNF3O3H5C8 (1)
Stoich.:	ABC3D3E5F8 (1)
Weight, g/mol:	263.034921
ΔH_f, kcal/mol:	-247.05
Dipole, Da:	2.37
IP(EA), eV:	-10.17(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-2-(3-methylphenoxy)pyridine-4-carboxylic acid

Drug info:

PubChemData

Smile

C1=C(C(=CN=C1OCC(F)(F)F)Cl)C(=O)O

DOS

IR

Vibrations