Geometry & MOs

Info

ID:	51
PubChem CID:	2022
Reduced:	O3N5C8H11 (1)
Stoich.:	A3B5C8D11 (1)
Weight, g/mol:	225.086189
ΔH_f, kcal/mol:	-60.01
Dipole, Da:	10.73
IP(EA), eV:	-9.51(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-9-(2-hydroxyethoxymethyl)-3H-purin-6-one

Drug info:

PubChemData

Smile

C1=NC2=C(N1COCCO)NC(=NC2=O)N

DOS

IR

Vibrations