Geometry & MOs

Info

ID:	278435
PubChem CID:	103835699
Reduced:	S2N3O3C12H17 (1)
Stoich.:	A2B3C3D12E17 (1)
Weight, g/mol:	317.111936
ΔH_f, kcal/mol:	-81.47
Dipole, Da:	8.09
IP(EA), eV:	-8.28(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)-2-phenylpropane-1-sulfonamide

Drug info:

PubChemData

Smile

CC(CNS(=O)(=O)C1=CNC2=C1C=CC=N2)(CSC)O

DOS

IR

Vibrations