Geometry & MOs

Info

ID:	425556
PubChem CID:	135126693
Reduced:	O4C35H68 (1)
Stoich.:	A4B35C68 (1)
Weight, g/mol:	636.605661
ΔH_f, kcal/mol:	-335.84
Dipole, Da:	2.17
IP(EA), eV:	-10.68(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-octadecanoyloxypropan-2-yl icosanoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCC(=O)OCC(C)OC(=O)CCCCCCCCCCCCC

DOS

IR

Vibrations