Geometry & MOs

Info

ID:

434487

PubChem CID:

135175034

Reduced:

FPSN5O5C10H13 (1)

Stoich.:

ABCD5E5F10G13 (1)

Weight, g/mol:

704.075003

ΔHf, kcal/mol:

-267.69

Dipole, Da:

11.02

IP(EA), eV:

 -9.33(-0.46)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(1R,4R,7S)-7-[[5-(2-amino-6-oxo-3H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-3-(6-aminopurin-9-yl)-2,5-dioxabicyclo[2.2.1]heptan-1-yl]methoxy-sulfanylphosphinic acid

Drug info:

PubChemData

Smile

C1[C@@H](C(OC1N2C=NC3=C2NC(=NC3=O)N)COP(=S)(O)O)F

DOS

IR

Vibrations