Geometry & MOs

Info

ID:	185648
PubChem CID:	77324861
Reduced:	ClN2O2F4H7C12 (1)
Stoich.:	AB2C2D4E7F12 (1)
Weight, g/mol:	521.141055
ΔH_f, kcal/mol:	-214.72
Dipole, Da:	3.68
IP(EA), eV:	-9.47(-2.19)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy-[2-[(6-aminopurin-9-yl)methoxy]ethoxy]-oxophosphanium

Drug info:

PubChemData

Smile

C1=C(C(=CC(=C1O)Cl)F)CC2C(=O)N=C(C=N2)C(F)(F)F

DOS

IR

Vibrations