Geometry & MOs

Info

ID:	371707
PubChem CID:	131270854
Reduced:	ClN2F3O3H4C7 (1)
Stoich.:	AB2C3D3E4F7 (1)
Weight, g/mol:	255.986254
ΔH_f, kcal/mol:	-260.63
Dipole, Da:	3.49
IP(EA), eV:	-9.44(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-6-chloro-5-(trifluoromethoxy)pyridine-2-carboxylic acid

Drug info:

PubChemData

Smile

C1=C(C(=C(N=C1Cl)C(=O)O)N)OC(F)(F)F

DOS

IR

Vibrations