Geometry & MOs

Info

ID:	11495
PubChem CID:	116314
Reduced:	I2N2O2C19H40 (1)
Stoich.:	A2B2C2D19E40 (1)
Weight, g/mol:	582.11792
ΔH_f, kcal/mol:	-125.84
Dipole, Da:	0.77
IP(EA), eV:	-7.6(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-4-[9-(4-methylmorpholin-4-ium-4-yl)nonyl]morpholin-4-ium;diiodide

Drug info:

PubChemData

Smile

C[N+]1(CCOCC1)CCCCCCCCC[N+]2(CCOCC2)C.[I-].[I-]

DOS

IR

Vibrations