Geometry & MOs

Info

ID:	73054
PubChem CID:	48416904
Reduced:	FSO3N5H12C17 (1)
Stoich.:	ABC3D5E12F17 (1)
Weight, g/mol:	367.07391
ΔH_f, kcal/mol:	-31.01
Dipole, Da:	8.17
IP(EA), eV:	-9.31(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(5-amino-4-cyanopyrazole-1-carbonyl)phenyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)N2C(=C(C=N2)C#N)N)NS(=O)(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations