Geometry & MOs

Info

ID:	352718
PubChem CID:	127283807
Reduced:	S2N3O3C12H17 (1)
Stoich.:	A2B3C3D12E17 (1)
Weight, g/mol:	272.155849
ΔH_f, kcal/mol:	-85.02
Dipole, Da:	5.85
IP(EA), eV:	-8.4(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,6-dimethylpiperidin-1-yl)-2-(1-oxo-1,4-thiazinan-4-yl)ethanone

Drug info:

PubChemData

Smile

C1CS(=O)CCN1CC(=O)NC(=O)NCC2=CC=CS2

DOS

IR

Vibrations