Geometry & MOs

Info

ID:	2750
PubChem CID:	8447
Reduced:	NS2H4C7 (2)
Stoich.:	AB2C4D7 (2)
Weight, g/mol:	331.957033
ΔH_f, kcal/mol:	115.68
Dipole, Da:	2.63
IP(EA), eV:	-9.06(-1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,3-benzothiazol-2-yldisulfanyl)-1,3-benzothiazole

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=C(S2)SSC3=NC4=CC=CC=C4S3

DOS

IR

Vibrations