Geometry & MOs

Info

ID:	175843
PubChem CID:	75959198
Reduced:	NPO9C26H46 (1)
Stoich.:	ABC9D26E46 (1)
Weight, g/mol:	577.337969
ΔH_f, kcal/mol:	-486.05
Dipole, Da:	6.63
IP(EA), eV:	-9.54(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-3-[(3-docosa-13,16-dienoyloxy-2-hydroxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

Drug info:

PubChemData

Smile

CCCCCC=CCC=CCC=CCCCCCCC(=O)OCC(COP(=O)(O)OCC(C(=O)O)N)O

DOS

IR

Vibrations