Geometry & MOs

Info

ID:	182034
PubChem CID:	76831425
Reduced:	SO4N5C22H29 (1)
Stoich.:	AB4C5D22E29 (1)
Weight, g/mol:	384.208279
ΔH_f, kcal/mol:	-106.69
Dipole, Da:	3.61
IP(EA), eV:	-9.41(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclohexyl-1-[1-(1,1-dioxo-1,4-thiazinane-4-carbonyl)piperidin-2-yl]propan-1-one

Drug info:

PubChemData

Smile

CCN1C(=NC(=N1)CC(=O)C2CCCCN2C(=O)N3CCS(=O)(=O)CC3)C4=CC=CC=C4

DOS

IR

Vibrations