Geometry & MOs

Info

ID:

59322

PubChem CID:

24778978

Reduced:

NPO8C46H86 (1)

Stoich.:

ABC8D46E86 (1)

Weight, g/mol:

805.562156

ΔHf, kcal/mol:

-515.07

Dipole, Da:

14.32

IP(EA), eV:

 -9.13(-0.32)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxy-3-[(9Z,12Z)-octadeca-9,12-dienoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations