Geometry & MOs

Info

ID:	48697
PubChem CID:	11110628
Reduced:	INO4H8C11 (1)
Stoich.:	ABC4D8E11 (1)
Weight, g/mol:	342.12054
ΔH_f, kcal/mol:	-81.23
Dipole, Da:	2.45
IP(EA), eV:	-9.82(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-amino-6-(cyclopropylmethylamino)purin-9-yl]ethoxymethylphosphonic acid

Drug info:

PubChemData

Smile

C1CC(=O)N(C1=O)OC(=O)C2=CC=C(C=C2)[124I]

DOS

IR

Vibrations