Geometry & MOs

Info

ID:	401744
PubChem CID:	135052402
Reduced:	BrNS3H8C9 (1)
Stoich.:	ABC3D8E9 (1)
Weight, g/mol:	172.892747
ΔH_f, kcal/mol:	83.67
Dipole, Da:	3.63
IP(EA), eV:	-8.29(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,4-dichloro-1lambda4,3-dithia-2-azacyclopenta-1,4-diene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CSC2=CSN=S2Br

DOS

IR

Vibrations