Geometry & MOs

Info

ID:	126281
PubChem CID:	50958411
Reduced:	ON3H19C21 (1)
Stoich.:	AB3C19D21 (1)
Weight, g/mol:	288.150764
ΔH_f, kcal/mol:	55.92
Dipole, Da:	5.0
IP(EA), eV:	-8.66(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,1-dioxo-1,4-thiazinan-4-yl)-1-(3-methylpiperidin-1-yl)propan-1-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(N(C=N2)CCCO)C3=CC4=CC=CC=C4N=C3

DOS

IR

Vibrations