Geometry & MOs

Info

ID:	179315
PubChem CID:	76465129
Reduced:	O6C55H96 (1)
Stoich.:	A6B55C96 (1)
Weight, g/mol:	804.720691
ΔH_f, kcal/mol:	-398.16
Dipole, Da:	2.66
IP(EA), eV:	-9.37(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-heptadec-9-enoyloxy-3-tetradecanoyloxypropan-2-yl) heptadecanoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCC=CCC=CCC=CCCCCC)OC(=O)CCCCCCCC=CCC=CCCCC

DOS

IR

Vibrations