Geometry & MOs

Info

ID:	146540
PubChem CID:	53702757
Reduced:	SN3O4C22H25 (1)
Stoich.:	AB3C4D22E25 (1)
Weight, g/mol:	293.185175
ΔH_f, kcal/mol:	-112.76
Dipole, Da:	3.47
IP(EA), eV:	-8.54(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(6-aminopurin-9-yl)nonane-1,2-diol

Drug info:

PubChemData

Smile

CCOC(=O)C1C(C(=C(N=C1C)C)C(=O)OCC)C2=CC(=CC=C2)NC3=NC=CS3

DOS

IR

Vibrations