Geometry & MOs

Info

ID:	168855
PubChem CID:	75028384
Reduced:	O2N6C15H20 (1)
Stoich.:	A2B6C15D20 (1)
Weight, g/mol:	369.164833
ΔH_f, kcal/mol:	-17.85
Dipole, Da:	3.75
IP(EA), eV:	-9.48(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[6-[[bis(2-hydroxyethyl)amino]methyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC(C(=O)NC(CC2=CN=CN2)C(=O)NN)N

DOS

IR

Vibrations