Geometry & MOs

Info

ID:	14738
PubChem CID:	419321
Reduced:	N7C10H11 (1)
Stoich.:	A7B10C11 (1)
Weight, g/mol:	229.107593
ΔH_f, kcal/mol:	131.26
Dipole, Da:	7.27
IP(EA), eV:	-9.65(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(1H-imidazol-5-yl)ethyl]-5H-purin-6-amine

Drug info:

PubChemData

Smile

C1=C(NC=N1)CCNC2=NC=NC3=NC=NC32

DOS

IR

Vibrations