Geometry & MOs

Info

ID:	141781
PubChem CID:	52927305
Reduced:	PO9C45H91 (1)
Stoich.:	AB9C45D91 (1)
Weight, g/mol:	804.624421
ΔH_f, kcal/mol:	-641.99
Dipole, Da:	3.47
IP(EA), eV:	-10.06(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-[[(2S)-2,3-dihydroxypropoxy]-hydroxyphosphoryl]oxy-3-icosoxypropan-2-yl] (Z)-nonadec-9-enoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCCCOC[C@H](COP(=O)(O)OC[C@H](CO)O)OC(=O)CCCCCCCCCCCCCCCCCC

DOS

IR

Vibrations