Geometry & MOs

Info

ID:	352698
PubChem CID:	127283787
Reduced:	SO2N3C11H19 (1)
Stoich.:	AB2C3D11E19 (1)
Weight, g/mol:	336.161997
ΔH_f, kcal/mol:	-24.15
Dipole, Da:	4.83
IP(EA), eV:	-8.56(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-oxo-1,4-thiazinan-4-yl)-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one

Drug info:

PubChemData

Smile

CC(C)(C)C1=NOC(=N1)CN2CCS(=O)CC2

DOS

IR

Vibrations