Geometry & MOs

Info

ID:	442424
PubChem CID:	135251984
Reduced:	ClC13H19 (1)
Stoich.:	AB13C19 (1)
Weight, g/mol:	1234.992615
ΔH_f, kcal/mol:	-34.9
Dipole, Da:	1.77
IP(EA), eV:	-8.98(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-O-[(13Z)-5,22-dioxo-1,4-dioxacyclodocos-13-en-2-yl] 17-O-[(E)-1-[(E)-octadec-9-enoyl]oxy-5-oxodocos-13-en-2-yl] (E)-heptadec-8-enedioate

Drug info:

PubChemData

Smile

CCCCCC1=CC(=C(C(=C1)C)Cl)C

DOS

IR

Vibrations