Geometry & MOs

Info

ID:

394580

PubChem CID:

135023254

Reduced:

O9C13H18 (2)

Stoich.:

A9B13C18 (2)

Weight, g/mol:

807.219748

ΔHf, kcal/mol:

-815.35

Dipole, Da:

5.03

IP(EA), eV:

 -10.08(0.35)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(4S)-3,4,5-triacetyloxy-6-[[(4S)-3,4,5-triacetyloxy-6-[N-phenyl-C-(trifluoromethyl)carbonimidoyl]oxyoxan-2-yl]methoxy]oxan-2-yl]methyl acetate

Drug info:

PubChemData

Smile

CC(=O)OCC1C([C@@H](C(C(O1)OCC2C([C@@H](C(C(O2)O)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

DOS

IR

Vibrations