Geometry & MOs

Info

ID:	289504
PubChem CID:	104358628
Reduced:	SCl2Br3H5C11 (1)
Stoich.:	AB2C3D5E11 (1)
Weight, g/mol:	457.80652
ΔH_f, kcal/mol:	52.39
Dipole, Da:	1.5
IP(EA), eV:	-9.5(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[bromo-(3-bromo-2-chlorophenyl)methyl]-2,5-dichloro-4-methoxybenzene

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Br)Cl)C(C2=CC(=C(S2)Br)Cl)Br

DOS

IR

Vibrations