Geometry & MOs

Info

ID:	183696
PubChem CID:	77059175
Reduced:	ON5C9H9 (1)
Stoich.:	AB5C9D9 (1)
Weight, g/mol:	250.007995
ΔH_f, kcal/mol:	72.08
Dipole, Da:	6.02
IP(EA), eV:	-9.5(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-chlorobenzimidazol-2-ylidene)-4-methyl-2H-thiadiazole

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C2=NC(=O)C(=C)C(=N2)N

DOS

IR

Vibrations