Geometry & MOs

Info

ID:

434443

PubChem CID:

135174929

Reduced:

O2N6C23H38 (1)

Stoich.:

A2B6C23D38 (1)

Weight, g/mol:

658.117616

ΔHf, kcal/mol:

17.77

Dipole, Da:

3.33

IP(EA), eV:

 -8.44(0.31)

Spin(Sz, S2):

 None, None

Charge, e:

 1

Chem-info

IUPAC name:

[(4R)-5-(4-aminoimidazo[4,5-c]pyridin-1-yl)-2-[[[2-(2-amino-6-oxo-3H-purin-9-yl)-5-(hydroxymethyl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-4-hydroxyoxolan-3-yl]oxy-hydroxy-oxophosphanium

Drug info:

PubChemData

Smile

CC1=CC(=NO1)CCCN2CCN(C(C2)C3CN(CCN3C)CCC4=NOC(=C4)C)C

DOS

IR

Vibrations