Geometry & MOs

Info

ID:

393158

PubChem CID:

135019600

Reduced:

O21C25H44 (1)

Stoich.:

A21B25C44 (1)

Weight, g/mol:

584.22326

ΔHf, kcal/mol:

-928.8

Dipole, Da:

6.53

IP(EA), eV:

 -9.93(0.06)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(2R,5R)-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)-2-phenylsulfanyloxan-3-yl] acetate

Drug info:

PubChemData

Smile

CO[C@@H]1C(C([C@@H](C(O1)CO)O)O)O[C@@H]2C(C([C@@H](C(O2)CO)O)O)O[C@@H]3C(C([C@@H](C(O3)CO)O)O[C@@H]4C(C([C@@H](C(O4)CO)O)O)O)O

DOS

IR

Vibrations