Geometry & MOs

Info

ID:

1634

PubChem CID:

4796

Reduced:

F2P3N5C11O12H16 (1)

Stoich.:

A2B3C5D11E12F16 (1)

Weight, g/mol:

540.997638

ΔHf, kcal/mol:

-726.63

Dipole, Da:

5.97

IP(EA), eV:

 -9.12(-0.55)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[[[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]-difluoromethyl]phosphonic acid

Drug info:

PubChemData

Smile

C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)OP(=O)(C(F)(F)P(=O)(O)O)O)O)O)N

DOS

IR

Vibrations