Geometry & MOs

Info

ID:	1206
PubChem CID:	3987
Reduced:	NaPO7C21H40 (1)
Stoich.:	ABC7D21E40 (1)
Weight, g/mol:	458.240935
ΔH_f, kcal/mol:	-482.76
Dipole, Da:	11.07
IP(EA), eV:	-9.56(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;(2-hydroxy-3-octadec-9-enoyloxypropyl) hydrogen phosphate

Drug info:

PubChemData

Smile

CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)(O)[O-])O.[Na+]

DOS

IR

Vibrations