Geometry & MOs

Info

ID:	70797
PubChem CID:	48413884
Reduced:	ClSO3N4H17C18 (1)
Stoich.:	ABC3D4E17F18 (1)
Weight, g/mol:	398.141262
ΔH_f, kcal/mol:	-43.87
Dipole, Da:	3.45
IP(EA), eV:	-9.24(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3,4-dimethylphenyl)sulfamoyl]-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)Cl

DOS

IR

Vibrations