Geometry & MOs

Info

ID:	12878
PubChem CID:	147491
Reduced:	O3N4C14H18 (1)
Stoich.:	A3B4C14D18 (1)
Weight, g/mol:	290.13789
ΔH_f, kcal/mol:	-48.53
Dipole, Da:	8.88
IP(EA), eV:	-9.13(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(dimethylamino)propylamino]-6-methoxyquinazoline-5,8-dione

Drug info:

PubChemData

Smile

CN(C)CCCNC1=NC=NC2=C1C(=O)C(=CC2=O)OC

DOS

IR

Vibrations