Geometry & MOs

Info

ID:

169115

PubChem CID:

75067066

Reduced:

SSi3N5O7C40H69 (1)

Stoich.:

AB3C5D7E40F69 (1)

Weight, g/mol:

758.403863

ΔHf, kcal/mol:

-411.5

Dipole, Da:

3.48

IP(EA), eV:

 -8.42(-0.41)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[9-[3,4-bis[[tert-butyl(dimethyl)silyl]oxy]-5-[[tert-butyl(dimethyl)silyl]oxymethyl]oxolan-2-yl]-2-(cyclopropylamino)purin-6-yl]oxypyridin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)S(=O)(=O)OC2=NC(=NC3=C2N=CN3C4C(C(C(O4)CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)NC5CC5)C

DOS

IR

Vibrations