Geometry & MOs

Info

ID:	10939
PubChem CID:	109308
Reduced:	O10C45H82 (1)
Stoich.:	A10B45C82 (1)
Weight, g/mol:	782.590799
ΔH_f, kcal/mol:	-592.74
Dipole, Da:	3.07
IP(EA), eV:	-9.32(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-2-[2-(2-hydroxy-3-octadec-9-enoyloxypropoxy)-2-oxoethyl]-4-octadecoxy-4-oxobutanoic acid

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCOC(=O)CC(CC(=O)OCC(COC(=O)CCCCCCCC=CCCCCCCCC)O)(C(=O)O)O

DOS

IR

Vibrations