Geometry & MOs

Info

ID:	25559
PubChem CID:	626355
Reduced:	OC10H11 (2)
Stoich.:	AB10C11 (2)
Weight, g/mol:	675.79524
ΔH_f, kcal/mol:	-49.54
Dipole, Da:	1.66
IP(EA), eV:	-7.88(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11,12,24,25-tetrabromo-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(26),9,11,13,22,24-hexaene

Drug info:

PubChemData

Smile

CCC1=C(C2=C(C=C(C=C2)OC)C3=C1C=CC(=C3)OC)CC

DOS

IR

Vibrations