Geometry & MOs

Info

ID:	222754
PubChem CID:	85332388
Reduced:	F2O3N4H28C29 (1)
Stoich.:	A2B3C4D28E29 (1)
Weight, g/mol:	518.995747
ΔH_f, kcal/mol:	-139.68
Dipole, Da:	1.86
IP(EA), eV:	-8.67(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[[5-(2-amino-6-oxo-5H-purin-9-yl)-4-hydroxy-3-methylideneoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate

Drug info:

PubChemData

Smile

C1CN(CCC12C3=CC=CC=C3C4=C2N=CC=C4)CCCNC(=O)N5C(COC5=O)C6=CC(=C(C=C6)F)F

DOS

IR

Vibrations