Geometry & MOs

Info

ID:	262113
PubChem CID:	103271360
Reduced:	ON3C12H19 (1)
Stoich.:	AB3C12D19 (1)
Weight, g/mol:	236.188863
ΔH_f, kcal/mol:	-23.78
Dipole, Da:	3.86
IP(EA), eV:	-9.27(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(1-prop-2-ynylpiperidin-4-yl)amino]methyl]cyclopentan-1-ol

Drug info:

PubChemData

Smile

CC(C1=NC=CN=C1)NCC2CCC(C2)O

DOS

IR

Vibrations