Geometry & MOs

Info

ID:	12544
PubChem CID:	140047
Reduced:	SH6C8 (2)
Stoich.:	AB6C8 (2)
Weight, g/mol:	268.038043
ΔH_f, kcal/mol:	77.15
Dipole, Da:	2.03
IP(EA), eV:	-8.27(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,6-diphenyldithiine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(SS2)C3=CC=CC=C3

DOS

IR

Vibrations