Geometry & MOs

Info

ID:	67726
PubChem CID:	46507040
Reduced:	ClSO2N3H18C22 (1)
Stoich.:	ABC2D3E18F22 (1)
Weight, g/mol:	432.092597
ΔH_f, kcal/mol:	12.2
Dipole, Da:	6.51
IP(EA), eV:	-8.71(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-ethoxyphenyl)sulfamoyl]-N-(3-methylsulfanylphenyl)-1H-pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)C2=NC3=CC=CC=C3N=C2NCC4=CC=C(C=C4)Cl

DOS

IR

Vibrations