Geometry & MOs

Info

ID:	374758
PubChem CID:	131342638
Reduced:	NOCl2F3H6C8 (1)
Stoich.:	ABC2D3E6F8 (1)
Weight, g/mol:	258.977854
ΔH_f, kcal/mol:	-199.3
Dipole, Da:	2.15
IP(EA), eV:	-10.2(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-3-(chloromethyl)-4-methyl-2-(trifluoromethoxy)pyridine

Drug info:

PubChemData

Smile

CC1=C(C(=CC(=N1)Cl)OC(F)(F)F)CCl

DOS

IR

Vibrations