Geometry & MOs

Info

ID:	383646
PubChem CID:	134975495
Reduced:	ClS2H9C10 (1)
Stoich.:	AB2C9D10 (1)
Weight, g/mol:	325.83931
ΔH_f, kcal/mol:	23.21
Dipole, Da:	5.75
IP(EA), eV:	-8.87(-1.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-1,5-dichloro-3-phenyl-1lambda4,2-dithiacyclopenta-3,5-diene

Drug info:

PubChemData

Smile

CC1=S(SC(=C1)C2=CC=CC=C2)Cl

DOS

IR

Vibrations