Geometry & MOs

Info

ID:	4406
PubChem CID:	11361
Reduced:	ON5C6H7 (1)
Stoich.:	AB5C6D7 (1)
Weight, g/mol:	165.06506
ΔH_f, kcal/mol:	19.56
Dipole, Da:	3.16
IP(EA), eV:	-9.24(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-7-methyl-3H-purin-6-one

Drug info:

PubChemData

Smile

CN1C=NC2=C1C(=O)N=C(N2)N

DOS

IR

Vibrations