Geometry & MOs

Info

ID:	9656
PubChem CID:	92028
Reduced:	O6C29H54 (1)
Stoich.:	A6B29C54 (1)
Weight, g/mol:	498.392039
ΔH_f, kcal/mol:	-372.3
Dipole, Da:	5.56
IP(EA), eV:	-10.64(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-diacetyloxypropyl docosanoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)C)OC(=O)C

DOS

IR

Vibrations