Geometry & MOs

Info

ID:	211618
PubChem CID:	81044560
Reduced:	SN2C16H28 (1)
Stoich.:	AB2C16D28 (1)
Weight, g/mol:	282.230728
ΔH_f, kcal/mol:	-3.1
Dipole, Da:	1.11
IP(EA), eV:	-8.8(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-(1-ethylpiperidin-4-yl)piperidin-3-yl]butanoic acid

Drug info:

PubChemData

Smile

CCN(CCC(C)C1CCCNC1)CC2=CC=CS2

DOS

IR

Vibrations