Geometry & MOs

Info

ID:

382337

PubChem CID:

134973423

Reduced:

SiO8C27H36 (1)

Stoich.:

AB8C27D36 (1)

Weight, g/mol:

550.223424

ΔHf, kcal/mol:

-330.42

Dipole, Da:

1.41

IP(EA), eV:

 -8.82(-0.77)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(3R,4S,6S)-4-[tert-butyl(dimethyl)silyl]oxy-2-[(1R,2S)-1,2-dihydroxy-3-methoxy-3-oxopropyl]-6-(furan-2-yl)-6-methoxyoxan-3-yl] benzoate

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)O[C@H]1C[C@](O[C@H]([C@H]1OC(=O)C2=CC=CC=C2)/C=C\C(=O)OC)(C3=CC=CO3)OC

DOS

IR

Vibrations