Geometry & MOs

Info

ID:	175853
PubChem CID:	75960634
Reduced:	PO13C45H77 (1)
Stoich.:	AB13C45D77 (1)
Weight, g/mol:	878.58843
ΔH_f, kcal/mol:	-694.9
Dipole, Da:	7.62
IP(EA), eV:	-9.26(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-3-octadec-9-enoyloxypropan-2-yl] nonadecanoate

Drug info:

PubChemData

Smile

CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)(O)OC1C(C(C(C(C1O)O)O)O)O)OC(=O)CCCCC=CCC=CCC=CCC=CCC

DOS

IR

Vibrations