Geometry & MOs

Info

ID:

394226

PubChem CID:

135022559

Reduced:

SSi3O6C31H66 (1)

Stoich.:

AB3C6D31E66 (1)

Weight, g/mol:

700.310131

ΔHf, kcal/mol:

-503.07

Dipole, Da:

3.78

IP(EA), eV:

-8.6(0.2)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

[(3aR,6R,7aR)-2,2-dimethyl-6-[[(6R,9R)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecan-8-yl]methylsulfanyl]-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-4-yl]methoxy-tert-butyl-diphenylsilane

Drug info:

PubChemData

Smile

C[C@H]1[C@@H](C(C[C@@H](O1)SC2[C@@H](C[C@@H](OC2C)OC)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations