Geometry & MOs

Info

ID:	166422
PubChem CID:	74687803
Reduced:	N2O3C17H26 (1)
Stoich.:	A2B3C17D26 (1)
Weight, g/mol:	241.117489
ΔH_f, kcal/mol:	-146.86
Dipole, Da:	8.7
IP(EA), eV:	-8.43(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-amino-7-(2-hydroxypropyl)-3-methyl-4,5-dihydropurine-2,6-dione

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)NC(=O)CC(C(=O)[O-])[NH2+]CCC(C)C)C

DOS

IR

Vibrations