Geometry & MOs

Info

ID:	179914
PubChem CID:	76554621
Reduced:	O2N3Cl4C25H27 (1)
Stoich.:	A2B3C4D25E27 (1)
Weight, g/mol:	340.129531
ΔH_f, kcal/mol:	-89.75
Dipole, Da:	3.83
IP(EA), eV:	-9.42(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(6-aminopurin-9-yl)-N-(3-fluoropropyl)-3,4-dihydroxyoxolane-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(CC(C1)NC(=O)C(CC2=C(C=C(C=C2)Cl)Cl)NC(=O)C3(CC3)C4=C(C=C(C=C4)Cl)Cl)N

DOS

IR

Vibrations