Geometry & MOs

Info

ID:	83847
PubChem CID:	49861750
Reduced:	NC7H13 (4)
Stoich.:	AB7C13 (4)
Weight, g/mol:	522.383118
ΔH_f, kcal/mol:	-57.78
Dipole, Da:	1.92
IP(EA), eV:	-8.51(2.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-cyclohexyl-N-[2-[1-(cyclohexylmethyl)piperidin-4-yl]ethyl]-4-propan-2-yldiazinan-3-amine;hydrate;dihydrochloride

Drug info:

PubChemData

Smile

C1CCC(CC1)CN2CCC(CC2)CCNC3C4CCCCC4C(NN3)C5CCCCC5

DOS

IR

Vibrations