Geometry & MOs

Info

ID:

222914

PubChem CID:

85333128

Reduced:

Si2O9C31H50 (1)

Stoich.:

A2B9C31D50 (1)

Weight, g/mol:

624.249017

ΔHf, kcal/mol:

-506.57

Dipole, Da:

3.17

IP(EA), eV:

 -9.74(-0.46)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[2-[3-acetamido-5-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-hydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoylamino]-5-amino-5-oxopentanoic acid

Drug info:

PubChemData

Smile

CC1C2C(C(=O)OC3C24COC(C1O)(C4C5(C(C3)C(=CC(=O)C5O[Si](C)(C)C)C)C)O[Si](C)(C)C)OC(=O)CC(C)C

DOS

IR

Vibrations