Geometry & MOs

Info

ID:	135934
PubChem CID:	51957059
Reduced:	SO3N4C15H16 (1)
Stoich.:	AB3C4D15E16 (1)
Weight, g/mol:	332.094312
ΔH_f, kcal/mol:	-20.68
Dipole, Da:	3.2
IP(EA), eV:	-9.2(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyano-N-[1-[[(2R)-oxolan-2-yl]methyl]pyrazol-4-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1C[C@H](OC1)CN2C=C(C=N2)NS(=O)(=O)C3=CC=C(C=C3)C#N

DOS

IR

Vibrations