Geometry & MOs

Info

ID:	5161
PubChem CID:	12686
Reduced:	ClNNaO2C16H33 (1)
Stoich.:	ABCD2E16F33 (1)
Weight, g/mol:	329.209751
ΔH_f, kcal/mol:	-180.34
Dipole, Da:	18.29
IP(EA), eV:	-9.2(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;2-[dodecyl(dimethyl)azaniumyl]acetate;chloride

Drug info:

PubChemData

Smile

CCCCCCCCCCCC[N+](C)(C)CC(=O)[O-].[Na+].[Cl-]

DOS

IR

Vibrations