Geometry & MOs

Info

ID:	798
PubChem CID:	3367
Reduced:	FO4N5C10H12 (1)
Stoich.:	AB4C5D10E12 (1)
Weight, g/mol:	285.087332
ΔH_f, kcal/mol:	-151.72
Dipole, Da:	4.09
IP(EA), eV:	-9.39(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-amino-2-fluoropurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol

Drug info:

PubChemData

Smile

C1=NC2=C(N=C(N=C2N1C3C(C(C(O3)CO)O)O)F)N

DOS

IR

Vibrations