Geometry & MOs

Info

ID:	6369
PubChem CID:	68325
Reduced:	INO2C7H15 (2)
Stoich.:	ABC2D7E15 (2)
Weight, g/mol:	544.0295
ΔH_f, kcal/mol:	-104.79
Dipole, Da:	56.32
IP(EA), eV:	-5.88(-3.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

trimethyl-[2-[4-oxo-4-[2-(trimethylazaniumyl)ethoxy]butanoyl]oxyethyl]azanium;diiodide

Drug info:

PubChemData

Smile

C[N+](C)(C)CCOC(=O)CCC(=O)OCC[N+](C)(C)C.[I-].[I-]

DOS

IR

Vibrations