Geometry & MOs

Info

ID:	229634
PubChem CID:	87568266
Reduced:	FSN2O4C32H35 (1)
Stoich.:	ABC2D4E32F35 (1)
Weight, g/mol:	281.235479
ΔH_f, kcal/mol:	-145.17
Dipole, Da:	4.24
IP(EA), eV:	-8.81(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-piperidin-1-yldodecane-1,3-dione

Drug info:

PubChemData

Smile

CC(=O)SC\1CCN(C/C1=C/C2=CN(C3=CC=CC=C32)C(=O)OC(C)(C)C)C(C4=CC=CC=C4F)C(=O)C5CC5

DOS

IR

Vibrations