Geometry & MOs

Info

ID:	48923
PubChem CID:	11528482
Reduced:	O3C10H20 (1)
Stoich.:	A3B10C20 (1)
Weight, g/mol:	189.06506
ΔH_f, kcal/mol:	-144.1
Dipole, Da:	4.08
IP(EA), eV:	-10.13(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-4H-imidazo[1,2-a]purin-9-one

Drug info:

PubChemData

Smile

CC(C)C[C@@H](/C=C/CO)OCOC

DOS

IR

Vibrations