Geometry & MOs

Info

ID:	23704
PubChem CID:	605437
Reduced:	N2O3H6C9 (1)
Stoich.:	A2B3C6D9 (1)
Weight, g/mol:	190.037842
ΔH_f, kcal/mol:	-54.03
Dipole, Da:	7.29
IP(EA), eV:	-9.05(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5H-[1,3]dioxolo[4,5-g]quinazolin-8-one

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C3C(=C2)C(=O)N=CN3

DOS

IR

Vibrations