Geometry & MOs

Info

ID:

390140

PubChem CID:

134997288

Reduced:

CrFSiO5C28H33 (1)

Stoich.:

ABCD5E28F33 (1)

Weight, g/mol:

878.333598

ΔHf, kcal/mol:

-147.55

Dipole, Da:

5.68

IP(EA), eV:

 -7.12(-0.03)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[6-[[3-acetyloxy-4,5-bis(phenylmethoxy)-6-phenylsulfanyloxan-2-yl]methoxy]-2-(hydroxymethyl)-4,5-bis(phenylmethoxy)oxan-3-yl] acetate

Drug info:

PubChemData

Smile

CCC1=C(C2=C(C3=CC=CC=C3C(=C2)F)C(=C1CC)OC)O[Si](C)(C)C(C)(C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr]

DOS

IR

Vibrations