Geometry & MOs

Info

ID:	14379
PubChem CID:	410507
Reduced:	ClH4C5N5 (1)
Stoich.:	AB4C5D5 (1)
Weight, g/mol:	169.015523
ΔH_f, kcal/mol:	102.94
Dipole, Da:	3.85
IP(EA), eV:	-10.0(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-5H-purin-2-amine

Drug info:

PubChemData

Smile

C1=NC2C(=N1)N=C(N=C2Cl)N

DOS

IR

Vibrations