Geometry & MOs

Info

ID:	372909
PubChem CID:	131306929
Reduced:	ClION2F3H3C8 (1)
Stoich.:	ABCD2E3F3G8 (1)
Weight, g/mol:	257.981918
ΔH_f, kcal/mol:	-121.51
Dipole, Da:	3.25
IP(EA), eV:	-10.06(-1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-3-fluoro-4-(trifluoromethoxy)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

C1=C(C(=C(C(=N1)I)Cl)CC#N)OC(F)(F)F

DOS

IR

Vibrations