Geometry & MOs

Info

ID:	22437
PubChem CID:	597194
Reduced:	ON2C3H3 (2)
Stoich.:	AB2C3D3 (2)
Weight, g/mol:	166.049075
ΔH_f, kcal/mol:	-42.44
Dipole, Da:	4.74
IP(EA), eV:	-8.93(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,5,7,8-tetrahydropteridine-2,6-dione

Drug info:

PubChemData

Smile

C1C(=O)NC2=C(N1)NC(=O)N=C2

DOS

IR

Vibrations