Geometry & MOs

Info

ID:	179323
PubChem CID:	76466821
Reduced:	O3C30H49 (2)
Stoich.:	A3B30C49 (2)
Weight, g/mol:	876.720691
ΔH_f, kcal/mol:	-327.74
Dipole, Da:	5.03
IP(EA), eV:	-9.41(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-hexadecanoyloxy-2-octadeca-6,9,12-trienoyloxypropyl) icosa-5,8,11,14-tetraenoate

Drug info:

PubChemData

Smile

CCCCCC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCC=CCC=CCC=CCC=CCC=CCC)OC(=O)CCCCCCC=CCC=CCC=CCCCCC

DOS

IR

Vibrations