Geometry & MOs

Info

ID:

219764

PubChem CID:

85164872

Reduced:

O4H17C18 (2)

Stoich.:

A4B17C18 (2)

Weight, g/mol:

594.234383

ΔHf, kcal/mol:

-197.05

Dipole, Da:

1.82

IP(EA), eV:

 -8.43(-0.75)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[4,5-diacetyloxy-3-[3-acetyloxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(2-trimethylsilylethoxy)oxan-2-yl]methyl acetate

Drug info:

PubChemData

Smile

CC1=C(C=C2C(=C1OC)C3C(C(O2)(OC4=CC(=C5CCC(OC5=C34)C6=CC=CC=C6)OC)C7=CC=CC=C7)OC(=O)C)OC

DOS

IR

Vibrations