Geometry & MOs

Info

ID:	278558
PubChem CID:	103836493
Reduced:	NSF3O3C13H18 (1)
Stoich.:	ABC3D3E13F18 (1)
Weight, g/mol:	261.114713
ΔH_f, kcal/mol:	-277.23
Dipole, Da:	7.08
IP(EA), eV:	-10.06(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxy-2,2-dimethylbutyl)-1-methylpyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CC(C)(CCO)CNS(=O)(=O)C1=CC=CC=C1C(F)(F)F

DOS

IR

Vibrations