Geometry & MOs

Info

ID:	12752
PubChem CID:	144958
Reduced:	ClNF3H3C6 (1)
Stoich.:	ABC3D3E6 (1)
Weight, g/mol:	180.990611
ΔH_f, kcal/mol:	-133.1
Dipole, Da:	1.13
IP(EA), eV:	-10.44(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-(trifluoromethyl)pyridine

Drug info:

PubChemData

Smile

C1=CN=C(C=C1C(F)(F)F)Cl

DOS

IR

Vibrations