Geometry & MOs

Info

ID:

390240

PubChem CID:

134997969

Reduced:

O9H30C31 (1)

Stoich.:

A9B30C31 (1)

Weight, g/mol:

2463.636649

ΔHf, kcal/mol:

-304.45

Dipole, Da:

7.32

IP(EA), eV:

 -9.98(-1.42)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[3-acetyloxy-4-[5-[5-acetyloxy-3-benzoyloxy-6-(benzoyloxymethyl)-4-[diethyl(propan-2-yl)silyl]oxyoxan-2-yl]oxy-4-(4,5-diacetyloxy-6-methyl-3-phenylmethoxyoxan-2-yl)oxy-6-(phenylmethoxymethyl)-3-(2,2,2-trichloroethoxycarbonylamino)oxan-2-yl]oxy-5-benzoyloxy-6-[4-(4,5-diacetyloxy-6-methyl-3-phenylmethoxyoxan-2-yl)oxy-6-hydroxy-2-(phenylmethoxymethyl)-5-(2,2,2-trichloroethoxycarbonylamino)oxan-3-yl]oxyoxan-2-yl]methyl benzoate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC(=C(C(=C1C(=O)C2=CC=CC=C2)OC(=O)OC(C)(C)C)C(=O)C3=CC=CC=C3)C(=O)OCC

DOS

IR

Vibrations