Geometry & MOs

Info

ID:	349917
PubChem CID:	127276722
Reduced:	SN5O5C13H17 (1)
Stoich.:	AB5C5D13E17 (1)
Weight, g/mol:	237.049336
ΔH_f, kcal/mol:	-169.47
Dipole, Da:	8.36
IP(EA), eV:	-9.53(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,1-dioxo-1,4-thiazinan-4-yl)-2-methylsulfanylpropan-1-one

Drug info:

PubChemData

Smile

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC(=O)N3CCS(=O)(=O)CC3

DOS

IR

Vibrations