Geometry & MOs

Info

ID:

398376

PubChem CID:

135033018

Reduced:

Si2N3O10C35H57 (1)

Stoich.:

A2B3C10D35E57 (1)

Weight, g/mol:

960.469589

ΔHf, kcal/mol:

-565.45

Dipole, Da:

6.11

IP(EA), eV:

 -9.02(-0.42)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tert-butyl (3S)-3-[[(4S,6R)-6-(azidomethyl)-2,2-diethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]oxy]-3-[(2R,5R)-3,4-bis[[tert-butyl(dimethyl)silyl]oxy]-5-(2,4-dioxopyrimidin-1-yl)oxolan-2-yl]-2-(phenylmethoxycarbonylamino)propanoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)C([C@@H]([C@@H]1C(C([C@@H](O1)N2C=CC(=O)NC2=O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O)NC(=O)OCC3=CC=CC=C3

DOS

IR

Vibrations