Geometry & MOs

Info

ID:

169114

PubChem CID:

75067005

Reduced:

O3C24H28 (1)

Stoich.:

A3B24C28 (1)

Weight, g/mol:

847.42255

ΔHf, kcal/mol:

-90.29

Dipole, Da:

2.19

IP(EA), eV:

 -8.66(-0.65)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC=C(C(=COC(C)C1=C(C=C(C=C1C)C)C)C)OC(=O)C2=CC=CC=C2

DOS

IR

Vibrations