Geometry & MOs

Info

ID:	352429
PubChem CID:	127283517
Reduced:	SN2O3C13H22 (1)
Stoich.:	AB2C3D13E22 (1)
Weight, g/mol:	286.135114
ΔH_f, kcal/mol:	-131.6
Dipole, Da:	2.51
IP(EA), eV:	-8.81(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(1-oxo-1,4-thiazinane-4-carbonyl)piperidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CC(C)C(=O)N1CCCC1C(=O)N2CCS(=O)CC2

DOS

IR

Vibrations