Geometry & MOs

Info

ID:	123258
PubChem CID:	50839809
Reduced:	N2S3O4C17H18 (1)
Stoich.:	A2B3C4D17E18 (1)
Weight, g/mol:	386.017718
ΔH_f, kcal/mol:	-102.71
Dipole, Da:	8.25
IP(EA), eV:	-8.94(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2-dimethyl-N-(2-methylsulfonyl-1,3-benzothiazol-6-yl)imidazole-4-sulfonamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)C1=NC2=C(S1)C=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)C)C

DOS

IR

Vibrations