Geometry & MOs

Info

ID:

401201

PubChem CID:

135050556

Reduced:

SiO4C20H40 (2)

Stoich.:

AB4C20D40 (2)

Weight, g/mol:

794.529671

ΔHf, kcal/mol:

-585.54

Dipole, Da:

1.22

IP(EA), eV:

 -8.8(0.95)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4R,6S)-4-[[(4R,6R)-6-[[(4R,6S)-4-cyano-2,2-dimethyl-6-[tri(propan-2-yl)silyloxymethyl]-1,3-dioxan-4-yl]methyl]-2,2-dimethyl-1,3-dioxan-4-yl]methyl]-2,2-dimethyl-6-[tri(propan-2-yl)silyloxymethyl]-1,3-dioxane-4-carbonitrile

Drug info:

PubChemData

Smile

CC(C)[Si](C(C)C)(C(C)C)OC[C@@H]1CC(OC(O1)(C)C)C[C@H]2C[C@@H](OC(O2)(C)C)CC3CC(OC(O3)(C)C)CO[Si](C(C)C)(C(C)C)C(C)C

DOS

IR

Vibrations