Geometry & MOs

Info

ID:

383458

PubChem CID:

134975196

Reduced:

SO5C36H40 (1)

Stoich.:

AB5C36D40 (1)

Weight, g/mol:

551.200915

ΔHf, kcal/mol:

-119.29

Dipole, Da:

1.74

IP(EA), eV:

 -8.66(-0.07)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(3S,6S)-4-acetyloxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(1,3-dioxoisoindol-2-yl)-6-ethylsulfanyloxan-3-yl] acetate

Drug info:

PubChemData

Smile

CCS[C@@H]1C(C([C@@H](O1)C(COCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5

DOS

IR

Vibrations