Geometry & MOs

Info

ID:

222142

PubChem CID:

85294679

Reduced:

SiC26H40 (1)

Stoich.:

AB26C40 (1)

Weight, g/mol:

944.275744

ΔHf, kcal/mol:

-7.88

Dipole, Da:

3.31

IP(EA), eV:

 -7.8(0.38)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6-[3-acetamido-2-[6-[5-acetamido-3-acetyloxy-2-(acetyloxymethyl)-6-hydroxyoxan-4-yl]oxy-2-carboxy-4,5-dihydroxyoxan-3-yl]oxy-5-acetyloxy-6-(acetyloxymethyl)oxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

Drug info:

PubChemData

Smile

CC1CCC(C(C1)[C]2[CH][CH][C]([CH]2)[Si](C)(C)[C]3[C]([C]([C]([C]3C)C)C)C)C(C)C

DOS

IR

Vibrations