Geometry & MOs

Info

ID:	23710
PubChem CID:	605448
Reduced:	SN4H6C8 (1)
Stoich.:	AB4C6D8 (1)
Weight, g/mol:	190.031317
ΔH_f, kcal/mol:	123.82
Dipole, Da:	6.14
IP(EA), eV:	-8.55(-2.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methyl-3H-imidazo[4,5-e][2,1,3]benzothiadiazole

Drug info:

PubChemData

Smile

CC1=NC2=CC=C3C(=NSN3)C2=N1

DOS

IR

Vibrations