Geometry & MOs

Info

ID:	431236
PubChem CID:	135171307
Reduced:	IN2H3O3C5 (1)
Stoich.:	AB2C3D3E5 (1)
Weight, g/mol:	259.132077
ΔH_f, kcal/mol:	-89.41
Dipole, Da:	4.99
IP(EA), eV:	-9.97(-1.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-6-piperidin-4-yloxyquinazolin-4-one

Drug info:

PubChemData

Smile

C1=C(C(=O)NC(=O)N1)C(=O)I

DOS

IR

Vibrations