Geometry & MOs

Info

ID:	272192
PubChem CID:	103734396
Reduced:	NSO3C10H23 (1)
Stoich.:	ABC3D10E23 (1)
Weight, g/mol:	235.124215
ΔH_f, kcal/mol:	-162.12
Dipole, Da:	6.54
IP(EA), eV:	-8.85(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)butan-2-ol

Drug info:

PubChemData

Smile

CC(C)S(=O)(=O)CCN(C)CC(C)(C)O

DOS

IR

Vibrations