Geometry & MOs

Info

ID:

434127

PubChem CID:

135174286

Reduced:

OS3C7H10 (1)

Stoich.:

AB3C7D10 (1)

Weight, g/mol:

712.061245

ΔHf, kcal/mol:

15.2

Dipole, Da:

3.08

IP(EA), eV:

-8.6(-0.88)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

[(3R)-3-[[5-(5-amino-7-oxo-2H-triazolo[4,5-d]pyrimidin-3-yl)-3-fluorooxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-4-fluorooxolan-2-yl]methoxy-sulfanylphosphinic acid

Drug info:

PubChemData

Smile

C#CCC1CSSCC1OS

DOS

IR

Vibrations