Geometry & MOs

Info

ID:	78054
PubChem CID:	49681607
Reduced:	S2N3O4C21H25 (1)
Stoich.:	A2B3C4D21E25 (1)
Weight, g/mol:	431.133734
ΔH_f, kcal/mol:	-97.33
Dipole, Da:	9.18
IP(EA), eV:	-8.74(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[methyl(propan-2-yl)sulfamoyl]-N-(3,4,7-trimethyl-1,3-benzothiazol-2-ylidene)benzamide

Drug info:

PubChemData

Smile

CCOC1=C2C(=CC=C1)SC(=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(C)C(C)C)N2C

DOS

IR

Vibrations