Geometry & MOs

Info

ID:	343990
PubChem CID:	127267166
Reduced:	SF3N3O3C13H14 (1)
Stoich.:	AB3C3D3E13F14 (1)
Weight, g/mol:	349.070797
ΔH_f, kcal/mol:	-222.09
Dipole, Da:	6.64
IP(EA), eV:	-8.9(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-ethyl-1-methylpyrazol-4-yl)-3-hydroxy-5-(trifluoromethyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)N1C=CC(=N1)NS(=O)(=O)C2=CC(=CC(=C2)O)C(F)(F)F

DOS

IR

Vibrations