Geometry & MOs

Info

ID:	175833
PubChem CID:	75956994
Reduced:	NPO7C46H82 (1)
Stoich.:	ABC7D46E82 (1)
Weight, g/mol:	683.452605
ΔH_f, kcal/mol:	-403.7
Dipole, Da:	13.55
IP(EA), eV:	-8.66(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-tetradec-9-enoyloxypropan-2-yl] octadeca-9,12,15-trienoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCC=COCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCC=CCC=CCC=CCC=CCC=CCC

DOS

IR

Vibrations