Geometry & MOs

Info

ID:	175851
PubChem CID:	75959704
Reduced:	PO10C41H79 (1)
Stoich.:	AB10C41D79 (1)
Weight, g/mol:	858.52583
ΔH_f, kcal/mol:	-656.45
Dipole, Da:	3.87
IP(EA), eV:	-9.61(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-2-octadeca-6,9,12-trienoyloxypropyl] octadec-9-enoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCC=CCCCCCCCC)COP(=O)(O)OCC(CO)O

DOS

IR

Vibrations