Geometry & MOs

Info

ID:	6808
PubChem CID:	70139
Reduced:	Cl2H3C4 (2)
Stoich.:	A2B3C4 (2)
Weight, g/mol:	243.919411
ΔH_f, kcal/mol:	-25.21
Dipole, Da:	1.79
IP(EA), eV:	-9.5(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2,3,5-tetrachloro-4,6-dimethylbenzene

Drug info:

PubChemData

Smile

CC1=C(C(=C(C(=C1Cl)Cl)Cl)C)Cl

DOS

IR

Vibrations