Geometry & MOs

Info

ID:	179328
PubChem CID:	76467278
Reduced:	O6C59H102 (1)
Stoich.:	A6B59C102 (1)
Weight, g/mol:	950.830241
ΔH_f, kcal/mol:	-394.05
Dipole, Da:	2.45
IP(EA), eV:	-9.34(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-heptadeca-9,12-dienoyloxy-2-icosa-11,14-dienoyloxypropyl) docos-11-enoate

Drug info:

PubChemData

Smile

CCCCCCCCCC=CCCCCCCCC(=O)OC(COC(=O)CCCCCCCC=CCC=CCCCC)COC(=O)CCCCCCC=CCC=CCC=CCCCCC

DOS

IR

Vibrations