Geometry & MOs

Info

ID:	83840
PubChem CID:	49861686
Reduced:	ON3C25H49 (1)
Stoich.:	AB3C25D49 (1)
Weight, g/mol:	541.437406
ΔH_f, kcal/mol:	-100.6
Dipole, Da:	2.33
IP(EA), eV:	-8.44(2.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-N-[3-[4-[8-(cyclohexylmethoxy)-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridin-2-yl]cyclohexyl]oxypropyl]butan-1-amine;hydrochloride

Drug info:

PubChemData

Smile

CCCCN(CCCC)CCCOC1CCC(CC1)C2CN3CCC(CC3N2)C

DOS

IR

Vibrations