Geometry & MOs

Info

ID:	393787
PubChem CID:	135021685
Reduced:	NOC8H8 (2)
Stoich.:	ABC8D8 (2)
Weight, g/mol:	359.02694
ΔH_f, kcal/mol:	-2.42
Dipole, Da:	2.93
IP(EA), eV:	-9.63(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-bromophenyl)-1,3,7-trimethylpyrido[3,2-d]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1(C=CC2(C=C1)N=C(C(=O)N2C)C3=CC=CC=C3)O

DOS

IR

Vibrations