Geometry & MOs

Info

ID:	59319
PubChem CID:	24778967
Reduced:	NPO8C44H80 (1)
Stoich.:	ABC8D44E80 (1)
Weight, g/mol:	781.562156
ΔH_f, kcal/mol:	-470.63
Dipole, Da:	17.79
IP(EA), eV:	-8.2(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-bis[[(9E,12Z)-octadeca-9,12-dienoyl]oxy]propyl 2-(trimethylazaniumyl)ethyl phosphate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations