Geometry & MOs

Info

ID:	374757
PubChem CID:	131342637
Reduced:	ClNOC13H14 (1)
Stoich.:	ABCD13E14 (1)
Weight, g/mol:	258.977854
ΔH_f, kcal/mol:	-23.9
Dipole, Da:	4.54
IP(EA), eV:	-9.25(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C2C=C(C(=CC2=C1)[C@@H](CCO)N)Cl

DOS

IR

Vibrations