Geometry & MOs

Info

ID:	280643
PubChem CID:	103850449
Reduced:	SN2O3C9H18 (1)
Stoich.:	AB2C3D9E18 (1)
Weight, g/mol:	238.044585
ΔH_f, kcal/mol:	-125.44
Dipole, Da:	6.89
IP(EA), eV:	-10.44(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyano-N-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)methanesulfonamide

Drug info:

PubChemData

Smile

CC(C)(C)CC(CNS(=O)(=O)CC#N)O

DOS

IR

Vibrations