Geometry & MOs

Info

ID:	141763
PubChem CID:	52925639
Reduced:	NPO10C39H74 (1)
Stoich.:	ABC10D39E74 (1)
Weight, g/mol:	761.520685
ΔH_f, kcal/mol:	-643.17
Dipole, Da:	4.63
IP(EA), eV:	-9.54(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-3-[hydroxy-[(2R)-3-[(Z)-icos-11-enoyl]oxy-2-tetradecanoyloxypropoxy]phosphoryl]oxypropanoic acid

Drug info:

PubChemData

Smile

CCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCC/C=C\CCCCCCCC)COP(=O)(O)OC[C@@H](C(=O)O)N

DOS

IR

Vibrations