Geometry & MOs

Info

ID:	339159
PubChem CID:	127260538
Reduced:	SCl2N2C18H20 (1)
Stoich.:	AB2C2D18E20 (1)
Weight, g/mol:	247.106925
ΔH_f, kcal/mol:	16.06
Dipole, Da:	1.96
IP(EA), eV:	-8.4(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3S)-5-(6-aminopurin-9-yl)-3-methyl-2,3-dihydrofuran-2-yl]methanol

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NCCCSCCCl.Cl

DOS

IR

Vibrations