Geometry & MOs

Info

ID:	271726
PubChem CID:	103689672
Reduced:	ClS2N3O3H10C12 (1)
Stoich.:	AB2C3D3E10F12 (1)
Weight, g/mol:	315.034748
ΔH_f, kcal/mol:	-34.31
Dipole, Da:	2.11
IP(EA), eV:	-8.99(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1,3-dimethylpyrazol-4-yl)sulfamoyl]-5-methylthiophene-2-carboxylic acid

Drug info:

PubChemData

Smile

CN(C1=CC(=CC=C1)O)S(=O)(=O)C2=C(N=C3N2C=CS3)Cl

DOS

IR

Vibrations