Geometry & MOs

Info

ID:	284635
PubChem CID:	104056377
Reduced:	ClSN2O3C13H19 (1)
Stoich.:	ABC2D3E13F19 (1)
Weight, g/mol:	321.008723
ΔH_f, kcal/mol:	-120.95
Dipole, Da:	5.34
IP(EA), eV:	-9.62(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-4-cyano-N-(4-cyano-2-methylpyrazol-3-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC(C1CCN(C1)S(=O)(=O)C2=C(C=C(C=C2)CN)Cl)O

DOS

IR

Vibrations