Geometry & MOs

Info

ID:	382017
PubChem CID:	134972920
Reduced:	Cl2O2H10C17 (1)
Stoich.:	A2B2C10D17 (1)
Weight, g/mol:	328.117155
ΔH_f, kcal/mol:	-1.95
Dipole, Da:	5.41
IP(EA), eV:	-9.46(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,5R)-2-(hydroxymethyl)-5-(6-phenylpurin-9-yl)oxolane-3,4-diol

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C2=CC(=C(C=C2)Cl)Cl)C(=O)C3=CC=CO3

DOS

IR

Vibrations