Geometry & MOs

Info

ID:	141771
PubChem CID:	52926175
Reduced:	NPO9C44H88 (1)
Stoich.:	ABC9D44E88 (1)
Weight, g/mol:	706.478485
ΔH_f, kcal/mol:	-651.18
Dipole, Da:	2.87
IP(EA), eV:	-9.73(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCCCC)COP(=O)(O)OC[C@@H](C(=O)O)N

DOS

IR

Vibrations