Geometry & MOs

Info

ID:	341237
PubChem CID:	127263672
Reduced:	ON2C9H10 (1)
Stoich.:	AB2C9D10 (1)
Weight, g/mol:	196.051574
ΔH_f, kcal/mol:	-16.14
Dipole, Da:	3.67
IP(EA), eV:	-10.12(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-7-propylpurine

Drug info:

PubChemData

Smile

C1CC(=O)N[C@@H]1C2=CC=NC=C2

DOS

IR

Vibrations