Geometry & MOs

Info

ID:	27564
PubChem CID:	822185
Reduced:	ON2H5C9 (2)
Stoich.:	AB2C5D9 (2)
Weight, g/mol:	240.041403
ΔH_f, kcal/mol:	25.03
Dipole, Da:	9.62
IP(EA), eV:	-9.23(-2.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-1,3,6-trimethylpteridine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=CC=CC=C3C4=C2NC5=NC(=O)NC(=O)C5=N4

DOS

IR

Vibrations