Geometry & MOs

Info

ID:	217252
PubChem CID:	85087505
Reduced:	Cl2O3H12C18 (1)
Stoich.:	A2B3C12D18 (1)
Weight, g/mol:	347.063085
ΔH_f, kcal/mol:	-30.03
Dipole, Da:	2.87
IP(EA), eV:	-9.7(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2-amino-6-oxo-5H-purin-9-yl)-5-(hydroxymethyl)oxolan-3-yl] dihydrogen phosphate

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=CC=O)Cl)OC2=CC=C(C=C2)C(=CC=O)Cl

DOS

IR

Vibrations