Geometry & MOs

Info

ID:

141779

PubChem CID:

52927285

Reduced:

PO9C45H91 (1)

Stoich.:

AB9C45D91 (1)

Weight, g/mol:

784.561821

ΔHf, kcal/mol:

-647.52

Dipole, Da:

0.62

IP(EA), eV:

 -9.7(0.23)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(2R)-1-[[(2S)-2,3-dihydroxypropoxy]-hydroxyphosphoryl]oxy-3-icosoxypropan-2-yl] (6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCCCC)COP(=O)(O)OC[C@H](CO)O

DOS

IR

Vibrations