Geometry & MOs

Info

ID:

381661

PubChem CID:

134972459

Reduced:

O16C25H36 (1)

Stoich.:

A16B25C36 (1)

Weight, g/mol:

650.205814

ΔHf, kcal/mol:

-715.96

Dipole, Da:

4.48

IP(EA), eV:

 -9.8(0.15)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[2-acetyloxy-2-[(2S,5R)-3,4-diacetyloxy-5-[2-acetyloxy-2-[(2S,5R)-3,4-diacetyloxy-5-methoxyoxolan-2-yl]ethoxy]oxolan-2-yl]ethyl] acetate

Drug info:

PubChemData

Smile

CC1[C@@H](C(C([C@@H](O1)OCC([C@H]2C(C([C@@H](O2)OC)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

DOS

IR

Vibrations