Geometry & MOs

Info

ID:	11805
PubChem CID:	121263
Reduced:	ClO2N3C15H20 (1)
Stoich.:	AB2C3D15E20 (1)
Weight, g/mol:	309.124405
ΔH_f, kcal/mol:	-110.52
Dipole, Da:	5.61
IP(EA), eV:	-8.86(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCN(CC1)CCN2C(=O)C3=CC=CC=C3NC2=O.Cl

DOS

IR

Vibrations