Geometry & MOs

Info

ID:	12680
PubChem CID:	143667
Reduced:	O4N5C13H19 (1)
Stoich.:	A4B5C13D19 (1)
Weight, g/mol:	309.143704
ΔH_f, kcal/mol:	-94.83
Dipole, Da:	4.26
IP(EA), eV:	-8.9(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[3,4-dimethoxy-5-(methoxymethyl)oxolan-2-yl]purin-6-amine

Drug info:

PubChemData

Smile

COCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)OC)OC

DOS

IR

Vibrations