Geometry & MOs

Info

ID:	9133
PubChem CID:	86412
Reduced:	ON2S2H6C8 (1)
Stoich.:	AB2C2D6E8 (1)
Weight, g/mol:	209.992155
ΔH_f, kcal/mol:	36.71
Dipole, Da:	5.1
IP(EA), eV:	-9.38(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-methyl 1,2,3-benzothiadiazole-7-carbothioate

Drug info:

PubChemData

Smile

CSC(=O)C1=C2C(=CC=C1)N=NS2

DOS

IR

Vibrations