Geometry & MOs

Info

ID:

231047

PubChem CID:

87572518

Reduced:

SiO8C86H134 (1)

Stoich.:

AB8C86D134 (1)

Weight, g/mol:

1322.984798

ΔHf, kcal/mol:

-460.28

Dipole, Da:

6.07

IP(EA), eV:

 -8.78(-0.07)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(2R,3R,4S,5R,6S)-6-[(2S)-2,3-bis[(3S,7S,11R)-3,7,11,15-tetramethylhexadecoxy]propoxy]-3,4,5-tris(phenylmethoxy)oxan-2-yl]methoxy-tert-butyl-diphenylsilane

Drug info:

PubChemData

Smile

C[C@H](CCC[C@H](C)CCCC(C)C)CCC[C@@H](C)CCOC[C@H](CO[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[Si](C2=CC=CC=C2)(C3=CC=CC=C3)C(C)(C)C)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OCC[C@H](C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C

DOS

IR

Vibrations