Geometry & MOs

Info

ID:	352431
PubChem CID:	127283519
Reduced:	SN2O3C13H22 (1)
Stoich.:	AB2C3D13E22 (1)
Weight, g/mol:	221.054421
ΔH_f, kcal/mol:	-136.93
Dipole, Da:	7.07
IP(EA), eV:	-8.52(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylsulfanyl-1-(1-oxo-1,4-thiazinan-4-yl)propan-1-one

Drug info:

PubChemData

Smile

CC(=O)NC1(CCCCC1)C(=O)N2CCS(=O)CC2

DOS

IR

Vibrations