Geometry & MOs

Info

ID:

59293

PubChem CID:

24778768

Reduced:

NPO8C42H78 (1)

Stoich.:

ABC8D42E78 (1)

Weight, g/mol:

779.546505

ΔHf, kcal/mol:

-493.96

Dipole, Da:

17.43

IP(EA), eV:

 -9.07(-0.45)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(2R)-3-[(Z)-hexadec-9-enoyl]oxy-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate

Drug info:

PubChemData

Smile

CCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC

DOS

IR

Vibrations