Geometry & MOs

Info

ID:	11967
PubChem CID:	124410
Reduced:	ON5C7H7 (1)
Stoich.:	AB5C7D7 (1)
Weight, g/mol:	177.06506
ΔH_f, kcal/mol:	31.19
Dipole, Da:	5.54
IP(EA), eV:	-9.15(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,6,7,8-tetrahydroimidazo[2,1-b]purin-4-one

Drug info:

PubChemData

Smile

C1CN2C3=C(C(=O)N=C2N1)NC=N3

DOS

IR

Vibrations