Geometry & MOs

Info

ID:	73101
PubChem CID:	48416994
Reduced:	SO4N5H17C19 (1)
Stoich.:	AB4C5D17E19 (1)
Weight, g/mol:	381.089561
ΔH_f, kcal/mol:	-26.72
Dipole, Da:	2.14
IP(EA), eV:	-8.93(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(5-amino-4-cyanopyrazole-1-carbonyl)-N-(2-methylphenyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3C(=C(C=N3)C#N)N

DOS

IR

Vibrations