Geometry & MOs

Info

ID:	15310
PubChem CID:	437502
Reduced:	N4C5H8 (1)
Stoich.:	A4B5C8 (1)
Weight, g/mol:	124.074896
ΔH_f, kcal/mol:	55.84
Dipole, Da:	3.46
IP(EA), eV:	-8.15(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,7,8,9-tetrahydro-2H-purine

Drug info:

PubChemData

Smile

C1NC2=C(N1)NCN=C2

DOS

IR

Vibrations