Geometry & MOs

Info

ID:	144708
PubChem CID:	53401097
Reduced:	NO3C11H15 (1)
Stoich.:	AB3C11D15 (1)
Weight, g/mol:	221.080041
ΔH_f, kcal/mol:	-122.14
Dipole, Da:	2.89
IP(EA), eV:	-8.88(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-6,7-dimethoxyquinazolin-4-one

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CC(CC(=O)O)N

DOS

IR

Vibrations