Geometry & MOs

Info

ID:	11804
PubChem CID:	121213
Reduced:	ClN3O3C14H18 (1)
Stoich.:	AB3C3D14E18 (1)
Weight, g/mol:	311.103669
ΔH_f, kcal/mol:	-139.83
Dipole, Da:	4.54
IP(EA), eV:	-8.94(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-morpholin-4-ylethyl)-1H-quinazoline-2,4-dione;hydrochloride

Drug info:

PubChemData

Smile

C1COCCN1CCN2C(=O)C3=CC=CC=C3NC2=O.Cl

DOS

IR

Vibrations