Geometry & MOs

Info

ID:

18329

PubChem CID:

539657

Reduced:

O17C33H48 (1)

Stoich.:

A17B33C48 (1)

Weight, g/mol:

716.28915

ΔHf, kcal/mol:

-758.69

Dipole, Da:

6.33

IP(EA), eV:

 -9.45(0.31)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[3,4-diacetyloxy-5-[[3,4,5-triacetyloxy-6-(6-hydroxy-2,6-dimethylocta-2,7-dienoxy)oxan-2-yl]methoxy]oxolan-2-yl]methyl acetate

Drug info:

PubChemData

Smile

CC(=CCCC(C)(C=C)O)COC1C(C(C(C(O1)COC2C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

DOS

IR

Vibrations