Geometry & MOs

Info

ID:	27567
PubChem CID:	822215
Reduced:	ClO2N4H11C14 (1)
Stoich.:	AB2C4D11E14 (1)
Weight, g/mol:	220.107259
ΔH_f, kcal/mol:	-10.1
Dipole, Da:	4.72
IP(EA), eV:	-9.55(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-2-(dimethylamino)-8-methylpteridin-7-one

Drug info:

PubChemData

Smile

CN1C2=C(C(=O)N(C1=O)C)N=C(C(=N2)C3=CC=CC=C3)Cl

DOS

IR

Vibrations