Geometry & MOs

Info

ID:	276901
PubChem CID:	103825660
Reduced:	SN3O3H13C14 (1)
Stoich.:	AB3C3D13E14 (1)
Weight, g/mol:	302.072513
ΔH_f, kcal/mol:	-29.88
Dipole, Da:	6.37
IP(EA), eV:	-10.07(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyano-N-[(1S)-2-hydroxy-1-phenylethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@@H](CO)NS(=O)(=O)C2=CN=C(C=C2)C#N

DOS

IR

Vibrations