Geometry & MOs

Info

ID:	50849
PubChem CID:	12013438
Reduced:	S3Br4C8 (1)
Stoich.:	A3B4C8 (1)
Weight, g/mol:	431.677
ΔH_f, kcal/mol:	108.72
Dipole, Da:	2.22
IP(EA), eV:	-8.88(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C12=C(SC3=C1C(=C(S3)Br)Br)SC(=C2Br)Br

DOS

IR

Vibrations