Geometry & MOs

Info

ID:	59303
PubChem CID:	24778840
Reduced:	NPO8C46H92 (1)
Stoich.:	ABC8D46E92 (1)
Weight, g/mol:	813.624756
ΔH_f, kcal/mol:	-587.85
Dipole, Da:	13.21
IP(EA), eV:	-9.72(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-2-[(5Z,8Z)-icosa-5,8-dienoyl]oxy-3-octadecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C

DOS

IR

Vibrations