Geometry & MOs

Info

ID:	11616
PubChem CID:	118216
Reduced:	OBr5H7C9 (1)
Stoich.:	AB5C7D9 (1)
Weight, g/mol:	529.63728
ΔH_f, kcal/mol:	-8.29
Dipole, Da:	2.47
IP(EA), eV:	-9.85(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=C(C=C(C(=C1Br)OCC(CBr)Br)Br)Br

DOS

IR

Vibrations