Geometry & MOs

Info

ID:	433831
PubChem CID:	135173974
Reduced:	ON4C12H20 (1)
Stoich.:	AB4C12D20 (1)
Weight, g/mol:	460.98249
ΔH_f, kcal/mol:	9.04
Dipole, Da:	3.28
IP(EA), eV:	-8.41(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-iodo-2-(4-iodopiperazin-1-yl)-7-azaspiro[3.5]nonane

Drug info:

PubChemData

Smile

CN1CCN(CC1)CC2=NN=C(C=C2)COC

DOS

IR

Vibrations