Geometry & MOs

Info

ID:	268983
PubChem CID:	103603906
Reduced:	OSCl3C9H9 (1)
Stoich.:	ABC3D9E9 (1)
Weight, g/mol:	403.79037
ΔH_f, kcal/mol:	-41.08
Dipole, Da:	2.27
IP(EA), eV:	-8.91(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3,5-tribromo-2-(2-methylsulfanylethoxy)benzene

Drug info:

PubChemData

Smile

CSCCOC1=C(C=C(C=C1Cl)Cl)Cl

DOS

IR

Vibrations