Geometry & MOs

Info

ID:	8293
PubChem CID:	76032
Reduced:	NSH7C8 (2)
Stoich.:	ABC7D8 (2)
Weight, g/mol:	298.059841
ΔH_f, kcal/mol:	81.93
Dipole, Da:	0.16
IP(EA), eV:	-7.03(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-2-(3-methyl-1,3-benzothiazol-2-ylidene)-1,3-benzothiazole

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2SC1=C3N(C4=CC=CC=C4S3)C

DOS

IR

Vibrations