Geometry & MOs

Info

ID:	50848
PubChem CID:	12013437
Reduced:	Br2H2S3C8 (1)
Stoich.:	A2B2C3D8 (1)
Weight, g/mol:	511.58547
ΔH_f, kcal/mol:	95.37
Dipole, Da:	0.15
IP(EA), eV:	-8.73(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4,10,11-tetrabromo-5,7,9-trithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),3,10-tetraene

Drug info:

PubChemData

Smile

C1=C(SC2=C1C3=C(S2)SC(=C3)Br)Br

DOS

IR

Vibrations