Geometry & MOs

Info

ID:	176383
PubChem CID:	76041049
Reduced:	O5C43H80 (1)
Stoich.:	A5B43C80 (1)
Weight, g/mol:	706.647526
ΔH_f, kcal/mol:	-368.39
Dipole, Da:	2.38
IP(EA), eV:	-9.52(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-hydroxy-2-octadecanoyloxypropyl) tetracos-15-enoate

Drug info:

PubChemData

Smile

CCCCCCCCC=CCCCCCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCC=CCCCCCC

DOS

IR

Vibrations