Geometry & MOs

Info

ID:	147462
PubChem CID:	53787118
Reduced:	NO4C20H25 (1)
Stoich.:	AB4C20D25 (1)
Weight, g/mol:	618.522325
ΔH_f, kcal/mol:	-176.42
Dipole, Da:	8.73
IP(EA), eV:	-8.6(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-acetyloxy-2-octadeca-9,12,15-trienoxypropyl) hexadecanoate

Drug info:

PubChemData

Smile

CC1=C(C(=C(C2=C1COC2=O)N)CC=C(C)C3CCCC3C(=O)O)C

DOS

IR

Vibrations