Geometry & MOs

Info

ID:

392907

PubChem CID:

135018420

Reduced:

Si4O7C55H106 (1)

Stoich.:

A4B7C55D106 (1)

Weight, g/mol:

475.235873

ΔHf, kcal/mol:

-596.16

Dipole, Da:

3.08

IP(EA), eV:

 -8.73(-0.13)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(2S,3aS,4S,5S,6S)-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)-2,3,3a,4,5,6-hexahydropyrrolo[1,2-b][1,2]oxazol-2-yl]methanol

Drug info:

PubChemData

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CC[Si](CC)(CC)O[C@](C)(/C=C/C[C@H](C)[C@@H](C[C@H](C)[C@H](C)O[Si](C)(C)C(C)(C)C)OC(=O)/C=C(\C)/[C@H](C)[C@@H](C=C)O[Si](C)(C)C(C)(C)C)C(=O)CC(=C)C[C@H](CC=C)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations