Geometry & MOs

Info

ID:	440172
PubChem CID:	135230081
Reduced:	N3C27H47 (1)
Stoich.:	A3B27C47 (1)
Weight, g/mol:	455.423949
ΔH_f, kcal/mol:	-52.58
Dipole, Da:	3.45
IP(EA), eV:	-8.78(2.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-10-[6-methyl-3-(5-methyl-6-azaspiro[3.5]nonan-8-yl)-7-azaspiro[4.5]decan-9-yl]-2-azaspiro[5.5]undecane

Drug info:

PubChemData

Smile

CC1C2(CCCC(C2)C3CC4(CCCC4C5CC6(CCC6)C(N5)C)C(N3)C)CCN1

DOS

IR

Vibrations