Geometry & MOs

Info

ID:	357587
PubChem CID:	127294260
Reduced:	OSN6C18H32 (1)
Stoich.:	ABC6D18E32 (1)
Weight, g/mol:	239.199762
ΔH_f, kcal/mol:	-16.73
Dipole, Da:	3.13
IP(EA), eV:	-8.71(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC(C)N1C=NN=C1SCC(=O)N2CCN(CC2)CC3CCCCN3C

DOS

IR

Vibrations