Geometry & MOs

Info

ID:	184949
PubChem CID:	77234545
Reduced:	S2O5N6C19H20 (1)
Stoich.:	A2B5C6D19E20 (1)
Weight, g/mol:	342.149204
ΔH_f, kcal/mol:	-89.17
Dipole, Da:	2.35
IP(EA), eV:	-8.72(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-2-methyl-5-[6-(2-phenylethyl)purin-9-yl]oxolan-3-ol

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CS2)CNC3=C4C(=NC=N3)N(C=N4)C5C(C(C(O5)CNS(=O)O)O)O

DOS

IR

Vibrations