Geometry & MOs

Info

ID:

185213

PubChem CID:

77271273

Reduced:

N2O11C40H58 (1)

Stoich.:

A2B11C40D58 (1)

Weight, g/mol:

521.266961

ΔHf, kcal/mol:

-381.96

Dipole, Da:

5.83

IP(EA), eV:

 -8.49(-0.54)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tert-butyl 2-[4-(6-aminopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]-2-[tert-butyl(dimethyl)silyl]oxyacetate

Drug info:

PubChemData

Smile

CC(C)C1=C(C(=NN1C=O)OC2C(C(C(C(O2)COC(=O)C(C)(C)C)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C)CC3=CC=CC=C3

DOS

IR

Vibrations