Geometry & MOs

Info

ID:	7342
PubChem CID:	72194
Reduced:	ClO2N5C10H12 (1)
Stoich.:	AB2C5D10E12 (1)
Weight, g/mol:	269.067952
ΔH_f, kcal/mol:	-33.14
Dipole, Da:	1.92
IP(EA), eV:	-9.18(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S,5R)-5-(6-amino-2-chloropurin-9-yl)oxolan-2-yl]methanol

Drug info:

PubChemData

Smile

C1C[C@@H](O[C@@H]1CO)N2C=NC3=C(N=C(N=C32)Cl)N

DOS

IR

Vibrations