Geometry & MOs

Info

ID:	202068
PubChem CID:	79623078
Reduced:	ClSO2N3C11H18 (1)
Stoich.:	ABC2D3E11F18 (1)
Weight, g/mol:	289.146013
ΔH_f, kcal/mol:	-70.53
Dipole, Da:	6.73
IP(EA), eV:	-9.44(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-1-[(1-methylsulfonylpiperidin-3-yl)methyl]piperidin-2-one

Drug info:

PubChemData

Smile

CS(=O)(=O)N1CCCC(C1)CN2C=C(C=N2)CCl

DOS

IR

Vibrations